data_2vrg_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 2vrg _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.6 ' HB2' HD23 ' A' ' 72' ' ' LEU . 98.3 mmm . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.655 0.264 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.63 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 41.0 t -88.01 147.82 41.7 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.175 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.66 -44.11 37.1 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.002 2.468 . . . . 0.0 114.125 -174.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.562 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 7.3 pt20 -56.81 -52.91 63.21 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.676 -177.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.63 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.1 pt-20 -73.1 -26.45 61.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.493 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.6 HD23 ' HB2' ' A' ' 67' ' ' MET . 18.0 mt -65.57 -17.68 64.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.717 0.294 . . . . 0.0 111.294 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.529 HE21 ' HA ' ' A' ' 70' ' ' GLN . 43.1 mt-30 -69.93 -47.28 63.01 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 172.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.2 tp -66.3 -19.64 65.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.582 174.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 26.6 t60 -68.19 -41.84 80.82 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.718 175.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.683 ' CD2' HG21 ' A' ' 100' ' ' VAL . 4.8 m-30 -66.49 -28.53 68.65 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.928 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 64.8 t80 -73.29 -53.87 9.77 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.649 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.456 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -79.62 -12.99 59.81 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.206 -175.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.407 ' HE2' ' HA ' ' A' ' 79' ' ' MET . 1.1 tpt -44.52 -41.3 6.31 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.839 0.712 . . . . 0.0 111.901 -174.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.657 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -140.81 9.91 2.19 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.863 179.573 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.427 ' HB2' HD23 ' A' ' 88' ' ' LEU . 27.3 t70 -86.26 88.81 7.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 110.268 178.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.489 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 21.7 m-85 -106.14 14.53 27.56 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.37 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -112.94 -15.41 12.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.319 -176.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 60.23 27.24 64.97 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.743 -0.662 . . . . 0.0 114.426 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -89.3 3.33 52.48 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 117.766 0.783 . . . . 0.0 110.765 -178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.928 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 2.6 t30 68.84 20.3 8.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.425 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.513 HD23 ' HB2' ' A' ' 135' ' ' TYR . 40.8 mt -143.27 158.47 43.6 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.574 0.702 . . . . 0.0 111.248 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 77' ' ' PHE . 70.6 mt -125.78 118.12 24.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.391 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.57 169.66 12.57 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.94 -35.69 54.16 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.403 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.5 mt -59.07 -42.8 91.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.262 0.553 . . . . 0.0 110.594 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.657 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 37.3 mt-10 -70.76 -50.59 34.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.035 0.921 . . . . 0.0 109.203 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.841 ' HB3' HG12 ' A' ' 97' ' ' ILE . 29.4 mt -65.77 -12.22 52.17 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.733 -171.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.687 ' HA ' HD11 ' A' ' 121' ' ' ILE . 24.4 p -55.61 -31.95 62.7 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.545 0.212 . . . . 0.0 111.4 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.83 -36.82 14.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.234 0.54 . . . . 0.0 111.145 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.557 ' O ' HG22 ' A' ' 100' ' ' VAL . . . -80.2 -43.91 20.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.744 -168.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.89 HG23 ' HA ' ' A' ' 121' ' ' ILE . 32.6 mm -62.82 -20.52 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.673 -174.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.691 HG21 HD23 ' A' ' 117' ' ' LEU . 17.5 m -56.39 -21.3 24.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.488 174.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -108.67 -44.5 4.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.207 174.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.683 HG21 ' CD2' ' A' ' 76' ' ' TYR . 2.9 t -59.16 -48.79 85.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.67 -173.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . 0.45 ' CD2' HG13 ' A' ' 120' ' ' ILE . 27.8 t60 . . . . . 0 N--CA 1.449 -0.522 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.765 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.406 ' HA ' ' HD3' ' A' ' 110' ' ' PRO . . . . . . . . 0 CA--C 1.507 -0.695 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 3.4 Cg_exo -79.41 67.73 8.51 Favored 'Trans proline' 0 N--CA 1.439 -1.702 0 C-N-CA 121.496 1.464 . . . . 0.0 111.379 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.71 83.47 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.945 0.879 . . . . 0.0 110.779 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 12.8 ptt? -102.95 -54.24 2.67 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.837 -176.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.7 m -161.38 119.15 2.31 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.616 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.04 -40.67 67.29 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.961 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.456 ' HA ' HD13 ' A' ' 118' ' ' ILE . 33.9 m-20 -71.9 -40.67 68.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.793 0.33 . . . . 0.0 110.926 -178.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -63.89 -37.02 85.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.469 0.652 . . . . 0.0 109.357 173.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.691 HD23 HG21 ' A' ' 98' ' ' THR . 12.5 tp -65.93 -31.97 73.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.066 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.616 HG13 ' O ' ' A' ' 114' ' ' GLU . 88.1 mt -61.18 -45.19 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.895 0.379 . . . . 0.0 110.249 174.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -66.76 -31.79 72.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.844 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.543 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -62.31 -42.57 95.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.202 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.89 ' HA ' HG23 ' A' ' 97' ' ' ILE . 80.3 mt -64.59 -48.27 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.903 176.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.533 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 70.6 m-20 -50.81 -48.17 59.78 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.25 -28.42 34.66 Favored Glycine 0 C--O 1.224 -0.471 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.491 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.782 HG22 HD11 ' A' ' 97' ' ' ILE . 54.9 t -72.08 -55.04 14.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 O-C-N 122.708 -0.289 . . . . 0.0 111.125 174.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.8 mp -65.92 -13.98 60.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.313 0.578 . . . . 0.0 111.044 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 47.7 mtt180 -110.48 -29.59 8.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.881 -175.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -125.91 -46.44 1.69 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.552 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 19.3 m-20 -68.06 -22.52 64.93 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 121.243 0.544 . . . . 0.0 110.275 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.461 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 0.8 OUTLIER -76.09 99.53 4.67 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.818 168.626 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -80.75 -17.43 51.0 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.657 -171.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.88 -0.08 43.11 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.531 -173.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.6 m120 61.75 37.53 15.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.996 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -99.6 -19.62 16.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.52 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 85.87 6.54 82.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.436 178.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.513 ' HB2' HD23 ' A' ' 87' ' ' LEU . 50.9 m-85 -126.78 160.74 29.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.452 HG23 HD23 ' A' ' 93' ' ' LEU . 7.3 tt -110.86 117.39 54.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.082 0.944 . . . . 0.0 110.568 178.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -90.33 168.64 11.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.258 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.793 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 7.3 t80 -51.83 -47.24 64.43 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.37 -26.49 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.04 0.447 . . . . 0.0 110.984 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.461 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 44.2 mt-10 -76.12 -53.31 8.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.97 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.793 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -72.49 -26.39 61.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.587 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.71 -42.42 97.19 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 174.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.444 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.5 mtmm -71.57 -28.92 64.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.781 176.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.1 t -80.21 -39.09 29.83 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.727 -172.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.991 -178.111 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.605 ' HB2' HD23 ' A' ' 72' ' ' LEU . 98.1 mmm . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 120.653 0.263 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -91.74 156.58 42.67 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.858 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.42 -50.75 12.82 Favored 'Trans proline' 0 N--CA 1.475 0.436 0 C-N-CA 122.85 2.367 . . . . 0.0 114.146 -173.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -62.45 -42.76 99.7 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.765 -174.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -77.6 -27.33 51.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.605 HD23 ' HB2' ' A' ' 67' ' ' MET . 13.5 mt -68.23 -17.96 64.44 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 120.745 0.307 . . . . 0.0 111.479 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.477 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 16.2 mt-30 -70.76 -45.74 64.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 171.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.76 -20.62 66.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.641 173.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.511 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 62.3 t60 -68.7 -33.24 73.61 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.385 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 4.3 m-30 -72.12 -31.51 66.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 175.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.653 ' HB2' ' HZ ' ' A' ' 141' ' ' PHE . 47.6 t80 -69.03 -53.2 21.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.284 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.548 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.56 -10.4 59.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.678 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.489 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 4.8 tpt -44.08 -39.43 4.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.904 0.881 . . . . 0.0 112.749 -171.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.506 ' O ' ' HG3' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -144.74 10.21 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.344 -178.92 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.785 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.5 t70 -74.83 94.84 2.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.617 0.722 . . . . 0.0 110.819 -176.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -122.02 18.83 10.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.652 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -108.08 -13.67 14.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -178.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 70.74 15.25 73.45 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.509 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -95.13 -4.85 45.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.657 0.728 . . . . 0.0 111.012 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.4 ' O ' HD21 ' A' ' 87' ' ' LEU . 47.2 m-80 62.69 19.76 11.6 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.691 177.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.508 HD13 ' HB2' ' A' ' 135' ' ' TYR . 2.4 mm? -129.14 163.31 25.79 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.644 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 86.9 mt -120.09 113.74 20.93 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 121.212 -0.195 . . . . 0.0 110.685 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.492 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 0.0 OUTLIER -86.25 175.66 8.35 Favored 'General case' 0 C--O 1.209 -1.059 0 O-C-N 123.794 0.684 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.44 -53.72 23.41 Favored Glycine 0 CA--C 1.518 0.232 0 N-CA-C 114.548 0.579 . . . . 0.0 114.548 -176.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.625 HD11 ' N ' ' A' ' 92' ' ' GLU . 3.9 pp -80.33 -28.63 38.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.574 0.687 . . . . 0.0 111.573 -172.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.785 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 40.7 tt0 -70.54 -51.45 28.61 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.891 0.853 . . . . 0.0 108.866 173.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 1.007 ' HG ' HG12 ' A' ' 97' ' ' ILE . 17.1 tp -65.95 -12.57 55.81 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.018 -179.165 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.756 ' HA ' HD11 ' A' ' 121' ' ' ILE . 28.0 m -52.96 -31.89 42.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.187 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 m -87.71 -22.26 24.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.07 0.462 . . . . 0.0 111.287 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.566 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -93.08 -39.18 11.22 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -171.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 1.007 HG12 ' HG ' ' A' ' 93' ' ' LEU . 43.6 mm -64.83 -21.55 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-O 120.962 0.41 . . . . 0.0 110.777 -179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.777 HG21 HD23 ' A' ' 117' ' ' LEU . 3.4 m -57.9 -24.77 59.21 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -111.78 -27.55 8.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.986 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.76 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 40.5 t -61.7 -59.81 3.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 175.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 49.4 t60 . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 121.312 0.577 . . . . 0.0 110.11 174.708 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.694 ' HB1' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.504 -0.812 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . 0.43 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.2 Cg_endo -79.84 67.1 8.72 Favored 'Trans proline' 0 N--CA 1.438 -1.748 0 C-N-CA 121.343 1.362 . . . . 0.0 111.625 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.21 78.97 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 122.144 0.973 . . . . 0.0 110.37 172.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.414 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.4 ptt? -97.76 -56.39 2.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.063 -1.426 . . . . 0.0 110.671 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.0 m -155.62 119.31 4.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.446 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.8 pt-20 -56.9 -37.5 71.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.868 -170.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.53 -45.23 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.451 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.53 -39.43 94.4 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.265 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.777 HD23 HG21 ' A' ' 98' ' ' THR . 13.2 tp -62.23 -38.36 88.93 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.288 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 114' ' ' GLU . 76.5 mt -63.46 -41.88 94.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 174.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -67.26 -30.6 70.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.307 0.575 . . . . 0.0 110.16 175.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.406 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -63.36 -43.0 98.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.1 173.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.756 HD11 ' HA ' ' A' ' 94' ' ' SER . 82.0 mt -63.79 -47.35 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.646 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.721 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 0.5 OUTLIER -52.52 -47.74 66.47 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.363 176.216 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.19 -34.38 53.22 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.18 -0.533 . . . . 0.0 111.903 177.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.724 HG23 HD11 ' A' ' 97' ' ' ILE . 52.5 t -65.78 -52.07 54.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.621 0.248 . . . . 0.0 110.661 175.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.401 HD12 HD22 ' A' ' 93' ' ' LEU . 8.9 mp -67.74 -1.05 4.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.67 -177.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.721 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.9 mtm180 -118.2 -32.62 4.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.605 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -123.77 -45.51 2.03 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -176.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.502 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 4.4 m-20 -71.97 -17.05 62.09 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.132 0.492 . . . . 0.0 110.4 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.55 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.8 t70 -76.36 93.25 3.44 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 166.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -79.37 -17.59 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.604 -168.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.45 8.07 16.42 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.244 -170.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.403 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 15.1 m120 61.02 36.2 18.62 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.984 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.7 p30 -98.38 -4.12 35.47 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.784 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.2 -16.27 23.86 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.986 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.508 ' HB2' HD13 ' A' ' 87' ' ' LEU . 16.5 m-85 -116.21 173.94 6.32 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.503 HD11 ' HB3' ' A' ' 141' ' ' PHE . 7.1 tt -108.7 121.98 62.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.705 177.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -91.58 170.11 10.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.345 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.76 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 38.1 t80 -52.33 -48.77 65.28 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.113 0.258 . . . . 0.0 110.63 -178.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.6 -28.01 69.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.928 0.394 . . . . 0.0 111.686 -176.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.55 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 47.7 mt-10 -76.98 -49.21 15.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.481 -173.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.76 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -76.29 -27.99 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.534 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.99 88.01 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.853 0.359 . . . . 0.0 110.553 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.411 ' HE3' ' HB2' ' A' ' 143' ' ' LYS . 47.6 mtmt -77.42 -29.01 52.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.527 175.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 21.7 t -75.58 -34.55 60.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.481 -175.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 pp . . . . . 0 CA--C 1.53 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.464 -178.806 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.795 ' HE2' ' HG3' ' A' ' 71' ' ' GLU . 96.9 mmm . . . . . 0 N--CA 1.463 0.194 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.436 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 55.3 m -116.8 162.99 24.38 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.431 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 81.1 Cg_exo -50.35 -49.33 16.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.284 2.656 . . . . 0.0 115.222 -172.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -59.31 -48.68 80.73 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -172.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.795 ' HG3' ' HE2' ' A' ' 67' ' ' MET . 1.7 pm0 -72.98 -28.65 62.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.707 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.617 HD23 ' HB2' ' A' ' 67' ' ' MET . 27.6 mt -68.09 -17.62 64.43 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.166 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 28.7 mt-30 -69.59 -47.46 63.46 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.91 -19.36 65.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.697 173.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.574 ' CE1' ' HE1' ' A' ' 79' ' ' MET . 25.1 t60 -71.57 -42.29 68.0 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.908 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.787 ' CD2' HG21 ' A' ' 100' ' ' VAL . 7.4 m-30 -66.95 -29.09 68.86 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.511 ' HA ' HD12 ' A' ' 88' ' ' LEU . 58.0 t80 -73.01 -50.39 23.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.864 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.429 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.3 mmmt -80.94 -26.62 36.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -175.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.574 ' HE1' ' CE1' ' A' ' 75' ' ' HIS . 22.3 tpp -44.72 -53.94 6.79 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -170.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.709 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -122.54 9.18 9.6 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.438 -174.532 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.661 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.0 t70 -83.89 72.8 10.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 109.554 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.427 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.8 OUTLIER -98.17 -7.02 30.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.915 -178.461 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -77.22 -13.65 59.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.8 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.3 24.06 74.19 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.414 -0.812 . . . . 0.0 113.381 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.465 ' ND2' ' HB2' ' A' ' 87' ' ' LEU . 14.1 p-10 -104.57 -9.71 18.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 117.64 0.72 . . . . 0.0 111.719 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.8 m120 67.71 30.21 6.54 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.538 HD21 ' HB2' ' A' ' 135' ' ' TYR . 13.6 mt -138.47 163.95 30.63 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.298 -0.865 . . . . 0.0 108.939 172.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' A' ' 77' ' ' PHE . 84.2 mt -125.86 117.51 23.52 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 123.23 0.331 . . . . 0.0 110.974 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.59 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.7 p30 -98.87 -170.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.317 177.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.12 -50.22 56.36 Favored Glycine 0 C--N 1.329 0.177 0 N-CA-C 114.32 0.488 . . . . 0.0 114.32 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.701 HD11 ' N ' ' A' ' 92' ' ' GLU . 3.7 pp -75.0 -29.48 60.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.52 0.66 . . . . 0.0 110.749 -173.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.709 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 47.9 mt-10 -68.8 -50.04 53.55 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.84 ' HB3' HG12 ' A' ' 97' ' ' ILE . 40.8 mt -66.82 -13.17 61.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.959 -178.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.636 ' HA ' HD11 ' A' ' 121' ' ' ILE . 48.4 m -57.39 -32.24 66.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.646 0.26 . . . . 0.0 111.321 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 m -92.39 -33.45 14.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 110.883 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.668 ' O ' HG22 ' A' ' 100' ' ' VAL . . . -80.98 -51.08 8.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.091 -169.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.84 HG12 ' HB3' ' A' ' 93' ' ' LEU . 24.3 mm -57.66 -24.68 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.908 -174.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.631 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 4.2 m -58.4 -22.14 52.91 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.188 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.502 ' CE1' ' HB3' ' A' ' 109' ' ' ALA . 43.8 m-70 -106.67 -19.84 13.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.826 174.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.787 HG21 ' CD2' ' A' ' 76' ' ' TYR . 12.4 t -86.01 -60.14 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -170.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . 0.412 ' CD2' HG13 ' A' ' 120' ' ' ILE . 74.1 t60 . . . . . 0 C--O 1.235 0.3 0 O-C-N 123.373 0.42 . . . . 0.0 111.766 -170.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.502 ' HB3' ' CE1' ' A' ' 99' ' ' HIS . . . . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 110.462 -0.199 . . . . 0.0 110.462 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . 0.631 ' HD2' ' O ' ' A' ' 98' ' ' THR . 45.4 Cg_endo -71.02 63.94 2.53 Favored 'Trans proline' 0 N--CA 1.455 -0.735 0 C-N-CA 122.11 1.873 . . . . 0.0 111.769 170.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.94 79.03 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.742 0.782 . . . . 0.0 111.299 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 18.3 ptt? -90.55 -59.16 2.25 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.67 177.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 75.4 m -167.36 129.93 1.68 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.601 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.4 OUTLIER -62.18 -28.26 69.54 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 123.264 0.352 . . . . 0.0 111.861 -175.028 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.71 -42.42 70.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -64.14 -40.71 96.74 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.494 HD13 ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER -62.76 -36.26 82.49 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.919 -1.492 . . . . 0.0 110.563 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.601 HG13 ' O ' ' A' ' 114' ' ' GLU . 68.6 mt -60.37 -43.48 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.904 0.383 . . . . 0.0 110.374 175.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.61 -38.32 87.19 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.606 0.717 . . . . 0.0 109.648 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.419 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -64.22 -39.99 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.3 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.777 ' HA ' HG23 ' A' ' 97' ' ' ILE . 79.2 mt -65.71 -41.82 91.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.466 178.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.764 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.1 t70 -62.94 -43.3 99.18 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.15 -30.39 57.66 Favored Glycine 0 C--O 1.224 -0.498 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.276 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.729 HG22 HD11 ' A' ' 97' ' ' ILE . 45.6 t -65.43 -49.28 79.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.747 0.308 . . . . 0.0 110.932 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.4 HD21 ' O ' ' A' ' 134' ' ' GLY . 96.2 mt -67.82 -9.89 48.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.995 0.426 . . . . 0.0 111.195 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.764 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.4 mtp85 -107.93 -34.78 6.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.308 -178.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -121.62 -47.31 2.22 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -171.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.505 ' HB2' HG12 ' A' ' 124' ' ' VAL . 15.1 m-20 -71.94 -21.11 61.65 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.058 0.456 . . . . 0.0 110.788 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.508 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.2 t70 -76.66 91.44 3.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 168.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -78.43 -18.25 55.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.627 -167.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -117.25 16.02 14.87 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.789 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 56.84 44.16 23.74 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.563 170.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.08 -15.46 15.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.692 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.4 ' O ' HD21 ' A' ' 125' ' ' LEU . . . 87.82 1.97 82.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.203 176.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.538 ' HB2' HD21 ' A' ' 87' ' ' LEU . 45.9 m-85 -132.74 170.88 14.62 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.56 HG23 HD22 ' A' ' 93' ' ' LEU . 7.1 tt -111.35 122.49 65.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.331 0.586 . . . . 0.0 109.739 174.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -103.3 -177.04 3.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.099 176.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.847 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.3 t80 -55.04 -48.99 72.7 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.551 0.532 . . . . 0.0 111.694 -171.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -23.18 64.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.004 0.43 . . . . 0.0 111.464 -175.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.508 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 51.7 mt-10 -80.69 -53.11 6.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -174.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.847 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.8 p90 -68.88 -32.11 71.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.047 177.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.77 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.998 0.428 . . . . 0.0 110.671 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -72.72 -29.34 63.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.38 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 9.0 t -79.84 -25.47 40.77 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -174.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.812 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 76.5 mt . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.311 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.665 ' HB2' HD22 ' A' ' 72' ' ' LEU . 93.5 mmm . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.828 0.347 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.545 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 5.8 m -85.53 153.83 58.84 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.874 177.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.593 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 18.9 Cg_endo -59.77 -26.96 83.8 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.463 2.775 . . . . 0.0 114.698 -169.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.401 ' HG3' ' H ' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -68.68 -54.92 13.35 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 121.421 0.629 . . . . 0.0 109.939 -177.155 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.7 pm0 -67.85 -27.04 66.35 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.249 174.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.74 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 15.1 mt -65.88 -20.62 66.29 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.403 177.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.764 ' HG2' HD11 ' A' ' 145' ' ' LEU . 20.8 mt-30 -72.22 -40.83 67.5 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.01 -24.38 65.11 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.74 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 18.0 t60 -68.92 -39.17 79.78 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.096 176.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.761 ' CD2' HG23 ' A' ' 100' ' ' VAL . 3.9 m-30 -66.94 -34.95 78.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.279 0.561 . . . . 0.0 109.813 175.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.534 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 59.1 t80 -68.48 -53.35 23.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.24 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -80.28 -12.33 59.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.61 -175.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.4 tpt -44.62 -38.89 4.59 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.928 0.768 . . . . 0.0 112.435 -172.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.796 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 1.0 OUTLIER -146.5 11.49 1.14 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.293 -179.645 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.733 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 25.0 t70 -82.56 90.9 6.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.614 0.721 . . . . 0.0 110.326 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -105.01 -10.84 16.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.4 p30 -83.89 -13.7 52.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.606 -173.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 64.09 24.43 68.7 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.358 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -95.07 5.12 52.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.343 0.572 . . . . 0.0 111.018 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.534 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 19.6 m120 59.19 32.34 21.96 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.129 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 27.5 mt -151.31 160.14 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.63 178.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.535 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 60.7 mt -121.32 123.54 42.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.503 176.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.574 ' OD2' ' HG ' ' A' ' 91' ' ' LEU . 0.1 OUTLIER -92.37 177.81 6.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.583 176.71 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.27 -34.71 54.09 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.206 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.574 ' HG ' ' OD2' ' A' ' 89' ' ' ASP . 27.7 mt -71.08 -47.05 60.49 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.176 0.512 . . . . 0.0 110.099 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.796 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 50.6 mt-10 -62.45 -41.59 98.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.547 0.689 . . . . 0.0 109.586 174.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.665 ' HB3' HG12 ' A' ' 97' ' ' ILE . 34.1 mt -68.44 -15.03 63.4 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.744 -175.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.726 ' HA ' HD11 ' A' ' 121' ' ' ILE . 26.6 t -59.9 -32.48 70.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.074 0.464 . . . . 0.0 110.445 178.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 -30.26 17.78 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.393 0.616 . . . . 0.0 110.382 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.569 ' O ' HG21 ' A' ' 100' ' ' VAL . . . -86.22 -55.49 3.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.969 -171.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.917 HG23 ' HA ' ' A' ' 121' ' ' ILE . 33.6 mm -59.03 -25.22 29.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 122.731 0.412 . . . . 0.0 111.793 -174.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.668 HG21 HD23 ' A' ' 117' ' ' LEU . 23.4 m -59.38 -16.06 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.219 0.533 . . . . 0.0 110.867 175.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 43.4 m-70 -110.77 -23.31 11.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.499 174.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.761 HG23 ' CD2' ' A' ' 76' ' ' TYR . 2.1 t -85.19 -45.9 17.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.731 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . 0.44 ' CD2' HG13 ' A' ' 120' ' ' ILE . 35.6 t60 . . . . . 0 N--CA 1.451 -0.38 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.838 -176.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.577 ' HA ' ' O ' ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.506 -0.738 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -85.06 69.36 5.69 Favored 'Trans proline' 0 N--CA 1.434 -1.98 0 C-N-CA 121.738 1.626 . . . . 0.0 110.711 176.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.8 mt -61.07 78.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.958 0.885 . . . . 0.0 111.04 174.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.4 ' H ' ' HG2' ' A' ' 112' ' ' MET . 11.6 ptt? -92.74 -56.97 2.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.474 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.9 m -158.61 125.76 4.89 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.423 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.52 -37.86 68.46 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.036 -176.546 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -60.24 -49.24 78.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.435 0.636 . . . . 0.0 110.11 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.13 -41.21 90.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.922 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.668 HD23 HG21 ' A' ' 98' ' ' THR . 8.1 tp -60.79 -39.69 89.82 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.561 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 114' ' ' GLU . 43.5 mt -59.01 -44.27 90.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.636 176.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -69.77 -31.61 69.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.645 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.44 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.2 mp -60.85 -46.5 96.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.125 174.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.917 ' HA ' HG23 ' A' ' 97' ' ' ILE . 83.9 mt -63.03 -47.26 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.251 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.805 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.8 t70 -60.5 -42.27 96.01 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.729 -179.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.49 -32.79 46.27 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.401 176.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.794 HG22 HD11 ' A' ' 97' ' ' ILE . 30.4 t -61.6 -51.1 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.7 0.286 . . . . 0.0 110.426 173.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.54 -10.81 48.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.129 0.49 . . . . 0.0 110.993 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.805 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 25.8 mtp180 -99.67 -32.96 10.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.568 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -136.5 -43.28 0.61 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -171.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.642 ' HB3' HG11 ' A' ' 124' ' ' VAL . 32.0 t0 -72.95 -22.15 60.76 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.383 0.611 . . . . 0.0 110.554 -176.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.26 101.18 6.13 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 168.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -78.42 -29.96 47.39 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.25 -168.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.02 -4.12 59.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.944 -174.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 59.11 36.43 24.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.741 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -96.81 -20.78 17.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.117 -176.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 106.24 -20.46 35.27 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.857 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -114.71 161.58 17.95 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.071 0.462 . . . . 0.0 110.554 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.648 HG23 HD23 ' A' ' 93' ' ' LEU . 6.5 tt -107.04 125.88 63.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.411 175.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -104.13 -176.86 3.2 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.813 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 10.8 t80 -54.49 -43.66 71.97 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.441 0.463 . . . . 0.0 111.494 -174.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.82 -37.05 81.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.577 0.227 . . . . 0.0 111.227 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.479 ' OE1' ' HA ' ' A' ' 136' ' ' ILE . 50.7 mt-10 -71.45 -53.4 14.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.986 -171.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.813 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -70.04 -23.17 63.06 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.825 -178.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . 0.522 ' HA ' HD13 ' A' ' 145' ' ' LEU . . . -79.65 -32.89 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.204 0.526 . . . . 0.0 110.496 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -69.55 -33.01 72.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.022 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 1.4 p -81.95 -30.57 31.66 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.764 HD11 ' HG2' ' A' ' 73' ' ' GLN . 6.7 mt . . . . . 0 C--O 1.233 0.222 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.149 170.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.64 ' HB2' HD22 ' A' ' 72' ' ' LEU . 97.2 mmm . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.459 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 20.3 m -93.54 158.23 37.14 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.912 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.538 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.4 Cg_exo -51.5 -45.68 36.18 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.129 2.552 . . . . 0.0 114.312 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' H ' ' HG3' ' A' ' 70' ' ' GLN . 1.1 mt-30 -57.24 -54.73 43.52 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.023 -173.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.608 ' HG3' ' HE2' ' A' ' 67' ' ' MET . 3.6 pm0 -71.16 -33.3 69.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.88 177.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.647 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 13.9 mt -62.72 -21.06 65.51 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.319 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.792 ' HG2' HD23 ' A' ' 145' ' ' LEU . 16.5 mt-30 -67.17 -48.03 69.21 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 173.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.2 tp -64.04 -22.34 66.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.526 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.647 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 36.0 t60 -72.01 -43.24 65.36 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.131 178.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.571 ' CE2' HD21 ' A' ' 145' ' ' LEU . 5.3 m-30 -62.82 -32.97 74.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 176.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.597 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 32.5 t80 -70.96 -52.65 18.56 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.206 -1.361 . . . . 0.0 110.46 -178.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.406 ' HE3' ' HA ' ' A' ' 78' ' ' LYS . 22.6 mmmt -79.89 -21.31 44.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.717 -175.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.523 ' HE1' ' CE1' ' A' ' 75' ' ' HIS . 19.1 tpp -44.95 -52.99 8.17 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 123.796 0.685 . . . . 0.0 112.2 -173.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.661 ' HA ' ' CE2' ' A' ' 82' ' ' TYR . 1.8 m170 -122.94 9.88 9.44 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.008 -175.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.568 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.0 t70 -82.69 56.01 3.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.78 0.8 . . . . 0.0 109.917 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.661 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 47.5 m-85 -71.95 -23.97 61.53 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.713 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.8 p30 -71.83 -14.88 62.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.685 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.74 28.27 65.33 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.132 -0.94 . . . . 0.0 113.491 177.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -96.07 3.81 53.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.498 0.649 . . . . 0.0 111.775 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.481 ' HA ' ' CZ ' ' A' ' 77' ' ' PHE . 12.5 m120 65.61 25.18 11.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.216 0.532 . . . . 0.0 111.492 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.464 HD23 ' HB2' ' A' ' 135' ' ' TYR . 13.4 mt -147.19 156.5 43.02 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.682 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 77' ' ' PHE . 75.8 mt -123.74 121.16 34.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.9 0.381 . . . . 0.0 111.536 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.464 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 13.4 t70 -83.21 168.29 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.394 173.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.51 55.21 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.609 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.464 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.4 mt -61.55 -43.31 99.09 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.491 0.662 . . . . 0.0 110.442 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.568 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.0 mt-10 -67.43 -46.53 72.88 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.959 0.885 . . . . 0.0 109.111 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.762 ' HB3' HG12 ' A' ' 97' ' ' ILE . 24.5 mt -66.61 -9.95 40.77 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.379 -173.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.684 ' HA ' HD12 ' A' ' 121' ' ' ILE . 36.2 t -54.4 -34.73 61.88 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.642 0.258 . . . . 0.0 111.301 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m -91.19 -30.99 16.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.395 -0.522 . . . . 0.0 111.244 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.59 -46.07 14.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.828 -171.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.84 HG23 ' HA ' ' A' ' 121' ' ' ILE . 43.6 mm -65.16 -22.18 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.364 -175.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.671 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 11.2 m -62.73 -15.27 52.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.435 ' CE1' ' HB3' ' A' ' 109' ' ' ALA . 61.9 m-70 -114.91 -25.76 8.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 174.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.695 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 58.7 t -66.3 -60.77 2.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.525 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 78.1 t60 . . . . . 0 C--O 1.233 0.237 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.908 -179.186 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.63 ' HB2' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.502 -0.882 0 N-CA-C 110.41 -0.218 . . . . 0.0 110.41 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . 0.671 ' HD2' ' O ' ' A' ' 98' ' ' THR . 57.3 Cg_endo -74.99 71.73 4.89 Favored 'Trans proline' 0 N--CA 1.443 -1.466 0 C-N-CA 121.273 1.315 . . . . 0.0 111.82 174.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.45 ' CD2' ' HB1' ' A' ' 109' ' ' ALA . 3.1 mm? -62.67 76.15 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.669 0.747 . . . . 0.0 110.623 170.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 22.5 ptt? -89.55 -59.23 2.27 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.398 -177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.7 m -163.04 117.49 1.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.487 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.47 -35.29 65.36 Favored 'General case' 0 C--O 1.219 -0.504 0 O-C-N 123.739 0.649 . . . . 0.0 112.03 -174.27 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -65.15 -47.05 78.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.114 0.483 . . . . 0.0 110.53 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.9 -38.62 79.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.682 176.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.423 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.1 tm? -58.0 -39.62 78.71 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.947 177.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 114' ' ' GLU . 39.9 mt -60.6 -46.02 96.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.067 175.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -64.7 -33.49 76.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.298 0.571 . . . . 0.0 110.209 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.3 mp -61.62 -47.92 91.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.437 175.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.84 ' HA ' HG23 ' A' ' 97' ' ' ILE . 70.4 mt -61.92 -43.96 98.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.64 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.642 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.6 t70 -63.08 -39.58 95.12 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.821 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.67 -28.84 60.51 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.911 177.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.714 HG22 HD11 ' A' ' 97' ' ' ILE . 45.5 t -61.8 -51.04 77.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.839 0.352 . . . . 0.0 110.918 174.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.38 -13.07 61.68 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.168 0.509 . . . . 0.0 110.9 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.642 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.6 mtm-85 -94.71 -50.06 5.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.626 -177.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -125.58 -31.61 2.96 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -173.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.54 ' CB ' ' HA ' ' A' ' 124' ' ' VAL . 9.6 t0 -75.14 -23.43 57.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.177 0.513 . . . . 0.0 110.637 -174.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.07 103.97 4.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 167.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -81.79 -18.66 43.33 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.417 -174.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . 0.481 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.1 m120 -83.3 -14.23 53.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.234 -172.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 131' ' ' ASN . 26.8 m-80 67.59 34.42 4.57 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.811 0.694 . . . . 0.0 110.365 -173.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.481 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -102.01 -21.36 14.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.8 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.27 4.61 77.29 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.466 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.464 ' HB2' HD23 ' A' ' 87' ' ' LEU . 59.6 m-85 -127.65 167.84 15.86 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.716 HG23 HD23 ' A' ' 93' ' ' LEU . 4.6 tt -107.86 122.69 62.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.93 0.872 . . . . 0.0 110.498 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -95.48 166.46 11.85 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.364 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.805 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 14.9 t80 -48.37 -47.68 37.21 Favored 'General case' 0 CA--C 1.523 -0.07 0 O-C-N 123.065 0.228 . . . . 0.0 110.869 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.386 -178.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.02 -50.27 64.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.89 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.805 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.2 p90 -74.03 -34.27 64.05 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.71 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.57 84.55 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.993 0.425 . . . . 0.0 110.239 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -72.2 -31.61 66.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.094 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 41.6 t -84.59 -37.04 21.63 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.367 -173.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.792 HD23 ' HG2' ' A' ' 73' ' ' GLN . 3.5 pp . . . . . 0 CA--C 1.53 0.196 0 CA-C-O 120.943 0.401 . . . . 0.0 110.963 -176.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.799 ' HE1' ' HG3' ' A' ' 71' ' ' GLU . 97.6 mmm . . . . . 0 N--CA 1.463 0.2 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.783 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 2.9 p -95.46 170.04 8.37 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.664 -0.207 . . . . 0.0 110.939 179.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.783 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 33.6 Cg_endo -61.9 -37.77 63.55 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.356 2.037 . . . . 0.0 114.252 -164.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -54.55 45.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.153 -174.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.799 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 1.5 pm0 -76.46 -28.83 56.69 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.003 178.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.499 ' CD2' ' HB2' ' A' ' 67' ' ' MET . 12.1 mt -63.21 -19.81 64.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.653 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -71.75 -45.42 61.75 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.37 -23.93 67.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.71 172.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.48 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 27.3 t60 -66.94 -39.78 87.39 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.787 176.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.833 ' HE1' HD22 ' A' ' 145' ' ' LEU . 5.2 m-30 -69.21 -25.65 64.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.264 0.554 . . . . 0.0 110.024 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.646 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 44.3 t80 -75.39 -54.23 7.4 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.819 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.646 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.9 mmmt -81.03 -17.38 50.43 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.468 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -45.74 -25.75 0.54 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.103 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.798 ' HE1' HD22 ' A' ' 93' ' ' LEU . 0.2 OUTLIER -157.93 9.56 0.17 Allowed 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.003 -165.385 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.55 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 27.8 t70 -89.12 61.78 5.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.736 0.779 . . . . 0.0 109.627 -176.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.418 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 11.6 m-85 -76.44 -24.13 53.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.932 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -70.34 -14.49 62.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.998 -174.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 63.13 28.14 71.67 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.85 -0.614 . . . . 0.0 113.218 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -96.76 -2.78 43.62 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 117.465 0.633 . . . . 0.0 110.396 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 59.11 34.98 23.63 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.493 HD21 ' HB2' ' A' ' 135' ' ' TYR . 7.6 mt -150.9 155.87 40.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.403 177.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.501 HD12 ' O ' ' A' ' 77' ' ' PHE . 2.3 mm? -114.48 112.04 22.35 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.561 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 12.7 t70 -82.9 161.98 21.7 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 173.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.497 ' HA3' ' HB2' ' A' ' 93' ' ' LEU . . . -54.93 -32.73 56.2 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.103 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.561 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 32.1 mt -59.73 -49.02 79.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.972 0.415 . . . . 0.0 110.31 178.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.55 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.6 mt-10 -63.28 -50.2 71.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.692 0.758 . . . . 0.0 109.15 173.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.798 HD22 ' HE1' ' A' ' 80' ' ' HIS . 46.2 mt -58.96 -15.11 11.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.548 -1.205 . . . . 0.0 113.432 -171.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.9 ' HA ' HD12 ' A' ' 121' ' ' ILE . 65.4 p -52.21 -33.68 42.19 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.294 0.371 . . . . 0.0 111.865 -178.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.39 -31.34 16.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.581 ' O ' HG21 ' A' ' 100' ' ' VAL . . . -94.93 -33.51 12.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -170.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.722 HD11 HG23 ' A' ' 124' ' ' VAL . 31.1 mm -63.67 -18.08 21.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.28 0.562 . . . . 0.0 110.283 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.68 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 2.6 m -60.01 -14.85 18.21 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.683 172.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.452 ' HB3' ' HH ' ' A' ' 76' ' ' TYR . 80.3 m-70 -115.81 -39.99 3.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 174.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.697 HG23 ' CD1' ' A' ' 76' ' ' TYR . 2.6 t -60.54 -53.59 46.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.984 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 64.3 t60 . . . . . 0 N--CA 1.451 -0.398 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 172.766 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.554 ' HB1' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 N--CA 1.443 -0.777 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . 0.68 ' HD2' ' O ' ' A' ' 98' ' ' THR . 39.2 Cg_endo -69.86 60.58 1.74 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.373 2.048 . . . . 0.0 111.665 172.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.49 77.53 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 121.931 0.872 . . . . 0.0 109.528 175.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.42 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.5 ptt? -83.52 -53.71 5.49 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.982 -1.463 . . . . 0.0 109.891 178.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 58.3 m -164.42 131.97 3.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 175.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.543 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.5 OUTLIER -61.85 -33.65 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.54 -173.695 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -70.51 -40.41 73.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 110.388 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -67.76 -37.72 82.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.621 HD23 HG21 ' A' ' 98' ' ' THR . 9.4 tp -62.02 -42.06 98.76 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.149 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.543 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.7 mt -56.71 -41.64 75.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.932 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -72.49 -33.82 67.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.722 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.02 -36.34 76.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 177.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.9 HD12 ' HA ' ' A' ' 94' ' ' SER . 86.5 mt -65.26 -44.4 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.016 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.752 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 35.0 t70 -63.2 -36.82 84.89 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.02 -32.0 59.2 Favored Glycine 0 C--N 1.332 0.334 0 N-CA-C 111.655 -0.578 . . . . 0.0 111.655 174.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.722 HG23 HD11 ' A' ' 97' ' ' ILE . 49.5 t -64.76 -49.16 81.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.883 0.373 . . . . 0.0 110.154 173.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.52 -10.62 36.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.295 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.752 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 29.2 mtm180 -99.09 -48.3 4.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.482 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -118.91 -37.25 3.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.519 ' HB2' HG12 ' A' ' 124' ' ' VAL . 17.5 m-20 -75.15 -19.64 59.77 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.02 0.438 . . . . 0.0 110.869 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.428 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 0.7 OUTLIER -79.45 94.23 5.52 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 167.281 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -79.47 -20.47 47.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.368 -172.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -82.68 -15.37 52.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.428 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 13.8 m120 62.64 37.96 12.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.277 -171.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -103.98 -5.6 22.05 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.36 -18.84 50.49 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.109 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.493 ' HB2' HD21 ' A' ' 87' ' ' LEU . 29.3 m-85 -115.74 166.31 12.09 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 116.983 0.392 . . . . 0.0 110.367 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.545 HD11 ' CG1' ' A' ' 124' ' ' VAL . 8.5 tt -103.4 121.93 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 CA-C-O 121.855 0.836 . . . . 0.0 109.727 176.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.79 172.13 7.25 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.492 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.863 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 19.1 t80 -51.08 -47.37 61.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.28 0.363 . . . . 0.0 110.969 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.5 71.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.373 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -81.34 -50.82 9.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.819 -171.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.863 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -70.22 -34.55 73.03 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.832 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . 0.482 ' HA ' HD13 ' A' ' 145' ' ' LEU . . . -68.07 -31.56 71.28 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.006 0.432 . . . . 0.0 110.465 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -76.68 -27.9 55.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.04 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.0 t -78.5 -18.69 54.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.833 HD22 ' HE1' ' A' ' 76' ' ' TYR . 76.8 mt . . . . . 0 N--CA 1.452 -0.356 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.562 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.62 ' HB2' HD23 ' A' ' 72' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.369 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.539 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 50.6 m -84.05 157.46 62.89 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.959 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.38 -45.66 36.07 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.101 2.534 . . . . 0.0 114.283 -172.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -64.15 -43.59 94.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.821 -171.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.539 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 2.5 pm0 -77.06 -26.46 53.56 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.372 174.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.62 HD23 ' HB2' ' A' ' 67' ' ' MET . 13.2 mt -63.21 -21.53 66.28 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.529 ' HG2' HD23 ' A' ' 145' ' ' LEU . 24.6 mt-30 -68.89 -44.99 72.09 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.49 -19.05 65.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.583 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.546 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 45.0 t60 -69.55 -34.15 73.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.373 -0.376 . . . . 0.0 109.992 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.695 ' CD2' HG23 ' A' ' 100' ' ' VAL . 5.1 m-30 -72.06 -27.83 62.94 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.56 ' O ' HD13 ' A' ' 88' ' ' LEU . 34.6 t80 -73.69 -52.66 12.52 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.738 176.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.527 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.28 -13.03 59.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -175.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.447 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 2.2 tpt -45.57 -38.26 6.29 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.173 0.589 . . . . 0.0 112.285 -173.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.04 11.14 1.77 Allowed 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.041 -178.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.736 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 35.1 t70 -79.74 84.33 5.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.648 0.737 . . . . 0.0 110.557 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -119.02 22.59 11.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.183 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.7 p30 -110.86 -14.11 14.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.769 -174.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 68.79 25.9 74.9 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.079 -0.51 . . . . 0.0 113.107 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -101.03 -1.95 32.92 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 117.46 0.63 . . . . 0.0 111.371 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 63.21 27.33 15.53 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.172 176.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.58 HD21 ' HB2' ' A' ' 135' ' ' TYR . 15.5 mt -153.27 167.61 28.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.461 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.56 HD13 ' O ' ' A' ' 77' ' ' PHE . 3.0 mm? -124.39 121.81 35.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.356 -179.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.565 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.2 p-10 -104.52 -179.25 3.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.83 -36.79 33.91 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 114.201 0.44 . . . . 0.0 114.201 -177.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.565 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 30.8 mt -64.3 -53.44 48.8 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.321 0.582 . . . . 0.0 110.552 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.736 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 41.6 mt-10 -62.95 -47.98 80.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.916 178.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.801 ' HB3' HG12 ' A' ' 97' ' ' ILE . 37.9 mt -66.23 -10.68 44.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.98 -174.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.937 ' HA ' HD11 ' A' ' 121' ' ' ILE . 24.0 t -56.4 -34.52 66.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.734 0.302 . . . . 0.0 110.845 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.9 m -92.22 -28.57 16.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.239 0.542 . . . . 0.0 111.569 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.527 ' O ' HG21 ' A' ' 100' ' ' VAL . . . -83.72 -47.13 11.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.739 -171.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.801 HG12 ' HB3' ' A' ' 93' ' ' LEU . 33.8 mm -60.14 -20.84 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.383 -175.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.811 HG23 ' HB1' ' A' ' 109' ' ' ALA . 8.9 m -51.02 -30.55 15.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.971 174.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.456 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 68.5 m-70 -103.82 -33.07 9.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.687 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.695 HG23 ' CD2' ' A' ' 76' ' ' TYR . 2.5 t -68.06 -51.74 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.478 -173.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 29.9 t60 . . . . . 0 C--O 1.234 0.242 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.847 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.811 ' HB1' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.508 -0.654 0 CA-C-O 120.429 0.157 . . . . 0.0 110.978 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.11 63.3 8.21 Favored 'Trans proline' 0 N--CA 1.445 -1.36 0 C-N-CA 121.886 1.724 . . . . 0.0 111.05 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.4 89.63 0.01 OUTLIER 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.837 0.827 . . . . 0.0 111.402 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.402 ' HG3' ' H ' ' A' ' 113' ' ' SER . 13.2 ptt? -93.48 -59.06 2.1 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.001 178.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.402 ' H ' ' HG3' ' A' ' 112' ' ' MET . 74.9 m -164.63 123.93 1.88 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 178.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.619 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.1 OUTLIER -54.04 -34.97 61.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.87 -174.788 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.459 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 21.2 t70 -71.36 -42.68 68.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.948 0.404 . . . . 0.0 110.666 -178.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.02 -38.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.859 0.838 . . . . 0.0 108.93 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.633 HD22 HG21 ' A' ' 98' ' ' THR . 9.5 tp -61.25 -37.1 81.88 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.333 177.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.619 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.0 mt -57.13 -43.7 81.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.474 175.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -65.49 -39.29 91.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.464 0.65 . . . . 0.0 109.607 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.423 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -61.46 -41.44 90.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.008 -0.996 . . . . 0.0 111.171 178.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.937 HD11 ' HA ' ' A' ' 94' ' ' SER . 90.1 mt -65.26 -38.58 82.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.953 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.797 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.8 t70 -63.7 -42.14 98.02 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.35 -32.0 57.25 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.368 176.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.787 HG23 HD11 ' A' ' 97' ' ' ILE . 46.5 t -61.82 -47.88 91.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.949 0.404 . . . . 0.0 110.215 174.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 66.3 mt -67.61 -7.45 26.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.82 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.797 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 22.5 mtp85 -103.48 -47.21 4.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.744 -178.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -112.7 -48.83 2.98 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.559 ' HB2' HG12 ' A' ' 124' ' ' VAL . 20.9 m-20 -68.84 -22.37 64.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.123 -174.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.576 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 6.1 t70 -76.35 80.3 3.1 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.432 ' HB3' ' HZ3' ' A' ' 130' ' ' LYS . 0.2 OUTLIER -69.55 -17.96 63.61 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 114.649 -1.159 . . . . 0.0 111.844 -169.09 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -116.85 10.23 14.1 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.928 -172.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.576 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 17.9 m120 53.63 44.63 29.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.579 173.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -99.13 -13.09 19.94 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.199 176.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.02 4.17 78.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.128 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.58 ' HB2' HD21 ' A' ' 87' ' ' LEU . 34.4 m-85 -133.65 176.68 8.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.456 HG23 HD23 ' A' ' 93' ' ' LEU . 8.3 tt -117.6 119.62 62.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.359 0.6 . . . . 0.0 109.73 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -97.53 -178.67 4.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.823 177.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.757 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.5 t80 -56.03 -47.92 76.93 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 123.44 0.463 . . . . 0.0 111.058 -173.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.99 66.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.959 0.409 . . . . 0.0 111.548 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.535 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 50.9 mt-10 -74.27 -53.87 8.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.849 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.757 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.8 p90 -72.84 -28.83 62.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.876 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.39 81.48 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 110.393 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -73.91 -32.16 63.42 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.025 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' SER . . . . . 0.449 ' HB3' HG11 ' A' ' 100' ' ' VAL . 9.0 t -81.3 -38.81 26.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.039 -171.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.529 HD23 ' HG2' ' A' ' 73' ' ' GLN . 4.3 pp . . . . . 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.646 -175.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.664 ' HE2' ' HG3' ' A' ' 71' ' ' GLU . 95.9 mmm . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.664 0.269 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.44 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 9.0 m -82.4 157.74 67.32 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.428 -178.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.533 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 75.0 Cg_exo -50.76 -48.94 18.43 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.902 2.401 . . . . 0.0 114.255 -173.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -59.92 -49.5 77.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.664 ' HG3' ' HE2' ' A' ' 67' ' ' MET . 5.3 pm0 -71.7 -28.92 64.03 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.737 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.507 HD23 ' HB2' ' A' ' 67' ' ' MET . 11.3 mt -64.27 -21.28 66.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.371 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 24.1 mt-30 -69.57 -46.31 66.68 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 49.1 tp -65.15 -20.91 66.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.896 173.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.529 ' CE1' ' HE3' ' A' ' 79' ' ' MET . 48.8 t60 -69.67 -43.3 72.81 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 76' ' ' TYR . 4.2 m-30 -65.69 -25.16 67.19 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.594 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 45.1 t80 -75.6 -53.56 8.4 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.039 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.594 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.3 mmmt -79.9 -30.88 40.22 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -173.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.529 ' HE3' ' CE1' ' A' ' 75' ' ' HIS . 17.3 tpp -47.93 -36.29 12.14 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -170.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.822 ' HE1' HD21 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -135.2 8.37 3.43 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -169.015 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.654 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.0 t70 -88.51 73.03 8.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.016 0.913 . . . . 0.0 109.354 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -72.08 -22.37 61.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.313 -175.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -87.06 -15.89 37.24 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.533 -175.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.42 ' HA3' ' OD1' ' A' ' 81' ' ' ASP . . . 62.58 29.69 74.35 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 115.545 -0.752 . . . . 0.0 114.401 175.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -94.19 6.87 47.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 117.783 0.791 . . . . 0.0 111.464 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 69.79 13.65 8.06 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.839 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.518 HD11 ' HB2' ' A' ' 135' ' ' TYR . 1.2 mm? -131.16 152.44 50.44 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.09 0.472 . . . . 0.0 110.309 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.714 HD23 ' CD2' ' A' ' 80' ' ' HIS . 14.5 mt -119.94 109.16 15.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.612 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.613 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 11.1 t70 -75.3 160.93 29.76 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . 0.5 ' HA3' ' HB2' ' A' ' 93' ' ' LEU . . . -53.4 -29.5 38.64 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 121.29 -0.481 . . . . 0.0 112.386 174.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.613 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.8 mt -60.35 -55.26 35.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 110.085 175.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.654 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 34.7 mt-10 -59.37 -53.02 62.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.207 174.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.822 HD21 ' HE1' ' A' ' 80' ' ' HIS . 69.1 mt -55.59 -17.07 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.897 -172.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.872 ' HA ' HD11 ' A' ' 121' ' ' ILE . 15.8 t -52.48 -32.01 37.83 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.362 0.414 . . . . 0.0 111.912 -177.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -29.4 17.43 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.463 ' HB2' ' CE1' ' A' ' 80' ' ' HIS . . . -98.13 -28.07 13.9 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -168.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.716 ' CG1' ' HB3' ' A' ' 93' ' ' LEU . 34.5 mm -66.52 -17.08 21.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.671 0.748 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.765 HG21 HD22 ' A' ' 117' ' ' LEU . 5.6 m -63.22 -17.2 62.18 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.735 172.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.425 ' CE1' ' HB3' ' A' ' 109' ' ' ALA . 98.9 m-70 -112.46 -21.41 11.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.074 0.464 . . . . 0.0 110.088 174.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.668 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.1 t -77.76 -59.39 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.149 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . 0.521 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.4 t60 . . . . . 0 C--O 1.234 0.24 0 CA-C-O 121.399 0.619 . . . . 0.0 109.811 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.425 ' HB3' ' CE1' ' A' ' 99' ' ' HIS . . . . . . . . 0 CA--C 1.504 -0.815 0 CA-C-O 120.604 0.24 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 1.1 Cg_endo -83.34 68.73 7.14 Favored 'Trans proline' 0 N--CA 1.432 -2.089 0 C-N-CA 121.708 1.605 . . . . 0.0 111.287 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.07 74.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.049 0.928 . . . . 0.0 110.28 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.449 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.3 ptt? -90.88 -50.75 5.71 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.597 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -159.4 125.45 4.37 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.539 ' O ' HG13 ' A' ' 118' ' ' ILE . 11.5 pt-20 -57.14 -41.88 79.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.391 -176.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -66.34 -50.28 64.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.979 0.418 . . . . 0.0 110.286 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.05 -41.32 78.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.245 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.765 HD22 HG21 ' A' ' 98' ' ' THR . 9.0 tp -63.76 -36.95 85.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 114' ' ' GLU . 87.6 mt -60.57 -44.0 95.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.231 174.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -66.47 -32.26 73.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.047 0.451 . . . . 0.0 110.459 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.521 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.64 -39.01 78.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.572 174.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.872 HD11 ' HA ' ' A' ' 94' ' ' SER . 46.3 mt -74.98 -19.26 16.35 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 CA-C-O 121.191 0.519 . . . . 0.0 110.591 177.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 30.2 t70 -74.11 -41.08 62.18 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.6 -35.92 63.31 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 114.588 -1.187 . . . . 0.0 113.211 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.837 HG12 HD13 ' A' ' 125' ' ' LEU . 7.2 p -62.56 -47.17 94.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 CA-C-N 117.529 0.664 . . . . 0.0 110.533 178.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.837 HD13 HG12 ' A' ' 124' ' ' VAL . 5.4 mp -70.44 -11.81 61.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.847 0.356 . . . . 0.0 111.379 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.68 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 20.2 mtm180 -92.92 -49.28 6.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -125.8 -26.8 3.43 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.593 ' HB2' HG22 ' A' ' 124' ' ' VAL . 41.8 m-20 -79.14 -28.47 42.83 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.685 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.5 96.41 3.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.578 0.704 . . . . 0.0 109.367 171.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -80.85 -18.75 46.36 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.768 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -78.58 -15.76 58.19 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.062 0.458 . . . . 0.0 110.16 -176.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 66.0 t30 59.67 33.28 21.88 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.601 -173.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -97.88 -16.8 19.6 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.275 -178.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.69 -34.62 5.46 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.687 178.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.518 ' HB2' HD11 ' A' ' 87' ' ' LEU . 6.9 m-85 -114.73 168.84 9.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.46 0.63 . . . . 0.0 111.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.503 HG21 HD11 ' A' ' 88' ' ' LEU . 0.2 OUTLIER -95.59 127.48 47.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.333 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -176.44 3.08 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.255 169.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.793 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.3 t80 -55.4 -48.09 74.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.569 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.22 -27.35 68.61 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.494 ' OE2' ' HA ' ' A' ' 136' ' ' ILE . 56.6 mt-10 -81.66 -47.93 12.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.79 -173.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.793 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.1 p90 -71.13 -30.44 66.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.494 176.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.27 86.47 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.514 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.46 -29.15 52.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.618 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 22.7 t -80.11 -33.94 38.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.398 -172.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.5 pp . . . . . 0 N--CA 1.465 0.283 0 CA-C-O 120.842 0.353 . . . . 0.0 111.41 -178.872 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.693 ' HB2' HD12 ' A' ' 72' ' ' LEU . 93.0 mmm . . . . . 0 C--O 1.232 0.149 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.457 ' O ' HD11 ' A' ' 72' ' ' LEU . 16.2 m -83.32 155.52 66.46 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.41 -41.36 43.63 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 123.022 2.481 . . . . 0.0 114.152 -172.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -57.56 -39.67 77.2 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.039 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.571 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 4.4 mm-40 -67.72 -44.83 76.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.815 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 10.0 mp -61.29 -21.85 64.32 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.075 -168.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -62.85 -49.68 73.91 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 28.1 tp -68.03 -24.31 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.911 174.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.815 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.4 t60 -67.07 -41.54 86.25 Favored 'General case' 0 C--O 1.225 -0.198 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.719 ' CD1' HG21 ' A' ' 100' ' ' VAL . 4.4 m-30 -72.4 -38.04 68.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.634 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.617 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 51.8 t80 -63.66 -51.55 64.62 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.69 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.587 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 23.7 mmmt -79.01 -19.12 52.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.2 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 16.8 tpp -44.16 -50.44 8.67 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.954 0.784 . . . . 0.0 112.203 -173.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.473 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -130.0 9.97 5.39 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.414 -0.515 . . . . 0.0 111.549 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.696 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.3 t70 -82.46 72.19 9.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.689 0.757 . . . . 0.0 110.09 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.1 13.58 30.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.059 178.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.1 p30 -101.65 -13.71 17.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.835 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 65.18 32.0 82.48 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.561 -0.745 . . . . 0.0 113.3 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -107.52 -4.54 18.3 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.597 0.698 . . . . 0.0 111.763 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.1 m120 68.37 12.31 8.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.027 0.531 . . . . 0.0 112.255 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.526 HD11 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -128.54 164.71 22.22 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.553 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 65.7 mt -126.32 119.26 26.9 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.235 174.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.483 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.3 p30 -99.0 -176.72 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 175.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.21 -36.6 52.86 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.758 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.483 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 46.4 mt -63.52 -47.24 82.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.178 0.513 . . . . 0.0 110.29 -177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.696 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 36.6 mt-10 -69.12 -49.95 52.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.742 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.779 ' HB3' HG12 ' A' ' 97' ' ' ILE . 35.1 mt -63.94 -14.7 55.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.263 -173.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.739 ' HA ' HD11 ' A' ' 121' ' ' ILE . 79.7 p -56.51 -37.54 70.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.859 0.361 . . . . 0.0 111.008 -178.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -91.71 -27.15 18.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.348 0.594 . . . . 0.0 111.141 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.609 ' O ' HG22 ' A' ' 100' ' ' VAL . . . -82.27 -48.51 11.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.605 -172.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.935 HG23 ' HA ' ' A' ' 121' ' ' ILE . 30.4 mm -59.66 -25.75 32.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.954 -174.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.649 HG21 HD22 ' A' ' 117' ' ' LEU . 20.9 m -55.94 -22.23 25.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.132 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -110.8 -11.43 14.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.499 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.719 HG21 ' CD1' ' A' ' 76' ' ' TYR . 2.7 t -95.1 -49.42 12.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -175.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . 0.559 ' CD2' HG13 ' A' ' 120' ' ' ILE . 69.8 t60 . . . . . 0 C--N 1.33 -0.274 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.308 -174.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.492 ' HB1' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.503 -0.849 0 CA-C-O 120.875 0.369 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -84.03 68.95 6.58 Favored 'Trans proline' 0 N--CA 1.431 -2.153 0 C-N-CA 121.288 1.326 . . . . 0.0 111.241 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.63 80.23 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 122.115 0.96 . . . . 0.0 110.782 172.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 10.1 ptt? -92.86 -58.03 2.46 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.315 -178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.9 m -159.68 122.11 3.43 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.608 ' O ' HG13 ' A' ' 118' ' ' ILE . 5.0 pm0 -56.44 -34.16 66.56 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -74.08 -35.23 64.22 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.204 -0.598 . . . . 0.0 110.135 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -68.63 -39.21 80.87 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.649 HD22 HG21 ' A' ' 98' ' ' THR . 11.6 tp -59.92 -39.02 84.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.296 177.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.608 HG13 ' O ' ' A' ' 114' ' ' GLU . 95.9 mt -61.22 -44.86 99.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.742 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -65.65 -32.88 74.7 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 109.987 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.559 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.49 -38.68 76.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.537 175.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.935 ' HA ' HG23 ' A' ' 97' ' ' ILE . 80.1 mt -68.42 -39.6 81.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.411 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.722 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.5 t70 -61.99 -44.85 95.86 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.11 -34.4 52.76 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.466 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.754 HG22 HG22 ' A' ' 97' ' ' ILE . 47.3 t -65.04 -48.35 84.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.86 0.362 . . . . 0.0 110.414 175.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.436 HD21 ' O ' ' A' ' 134' ' ' GLY . 88.1 mt -67.87 -4.88 14.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.08 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.722 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.4 mtm180 -103.29 -49.21 3.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -120.21 -35.41 3.45 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.625 ' HB2' HG12 ' A' ' 124' ' ' VAL . 26.3 m-20 -78.23 -16.7 57.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.153 0.501 . . . . 0.0 110.288 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.74 90.85 3.44 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.43 ' HB3' ' HZ3' ' A' ' 130' ' ' LYS . 0.1 OUTLIER -76.42 -17.04 59.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.731 -167.451 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -119.94 17.95 12.52 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 54.71 40.23 31.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.442 172.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 p30 -102.53 -11.49 18.49 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.261 177.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.436 ' O ' HD21 ' A' ' 125' ' ' LEU . . . 84.16 1.15 89.63 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.617 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.526 ' HB2' HD11 ' A' ' 87' ' ' LEU . 13.8 m-85 -127.59 178.86 5.83 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.642 HG23 HD23 ' A' ' 93' ' ' LEU . 3.7 tt -121.41 125.53 73.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -103.14 -177.62 3.43 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.104 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.88 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 15.2 t80 -56.66 -48.82 76.76 Favored 'General case' 0 C--O 1.227 -0.128 0 O-C-N 123.3 0.375 . . . . 0.0 110.838 -175.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.19 -21.91 64.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.694 0.283 . . . . 0.0 111.558 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -78.52 -56.78 4.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.88 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -67.63 -32.08 72.54 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.855 -0.738 . . . . 0.0 110.097 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.61 -39.95 78.04 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.953 0.406 . . . . 0.0 110.421 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.443 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.3 mtmm -75.34 -28.11 59.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.961 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.2 t -79.21 -19.01 51.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.803 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 68.3 mt . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.415 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.621 ' HE1' ' HG3' ' A' ' 71' ' ' GLU . 98.9 mmm . . . . . 0 N--CA 1.464 0.24 0 CA-C-O 121.142 0.496 . . . . 0.0 111.732 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.524 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 17.2 m -93.16 163.41 25.24 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.742 -178.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.576 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.6 Cg_exo -53.34 -49.92 15.76 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.809 2.339 . . . . 0.0 113.969 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.551 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 2.1 pt20 -61.77 -49.94 74.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.068 -176.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.621 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 0.8 OUTLIER -61.27 -43.34 99.03 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.675 175.077 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.539 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 12.3 mt -62.44 -22.85 66.52 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.702 -173.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.813 ' HG2' HD22 ' A' ' 145' ' ' LEU . 21.1 mt-30 -71.3 -39.67 71.32 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 175.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.51 -24.67 65.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.384 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.539 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 59.3 t60 -65.88 -46.43 78.43 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 175.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.449 ' CD1' HD23 ' A' ' 145' ' ' LEU . 3.3 m-30 -63.69 -33.65 76.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.189 0.519 . . . . 0.0 109.64 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.495 ' HA ' HD12 ' A' ' 88' ' ' LEU . 65.2 t80 -65.62 -51.91 56.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.204 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.429 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 27.4 mmmt -79.69 -15.5 57.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.547 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.43 ' HE2' ' HA ' ' A' ' 79' ' ' MET . 2.4 tpt -45.2 -44.29 10.84 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.597 0.759 . . . . 0.0 112.519 -170.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.855 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -137.41 10.29 2.96 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.706 -177.569 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.7 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.1 t70 -83.2 88.69 6.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.243 0.544 . . . . 0.0 110.21 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.435 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 26.7 m-85 -110.46 -0.91 17.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.149 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -87.64 -14.68 39.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.582 -174.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.97 78.0 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 121.162 -0.542 . . . . 0.0 113.425 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -95.41 -5.4 43.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 117.706 0.753 . . . . 0.0 111.311 -177.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 64.84 18.25 11.38 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.177 0.591 . . . . 0.0 112.033 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.546 HD11 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -130.4 167.76 18.06 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 172.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 77' ' ' PHE . 68.1 mt -131.04 117.28 18.93 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.813 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -93.76 -178.93 4.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.143 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -56.68 -33.89 63.64 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.128 -0.558 . . . . 0.0 113.331 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 19.9 mt -69.55 -48.38 60.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.176 0.512 . . . . 0.0 109.932 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.855 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 45.6 mt-10 -62.99 -49.24 75.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.886 0.85 . . . . 0.0 109.39 174.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.781 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.2 mt -66.57 -9.84 39.31 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.924 -1.034 . . . . 0.0 113.407 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.991 ' HA ' HD11 ' A' ' 121' ' ' ILE . 34.6 t -54.57 -31.64 57.03 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.024 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.05 -36.75 13.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 0.0 111.339 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.49 -39.26 22.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.845 -168.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.781 HG12 ' HB3' ' A' ' 93' ' ' LEU . 39.1 mm -67.87 -16.33 20.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.959 0.409 . . . . 0.0 111.16 -176.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.46 HG21 HD22 ' A' ' 117' ' ' LEU . 8.7 m -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.471 175.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -102.86 -23.72 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.275 174.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.738 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 73.4 t -77.97 -63.8 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.729 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . 0.467 ' CD2' HG13 ' A' ' 120' ' ' ILE . 13.3 t60 . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 121.249 0.547 . . . . 0.0 110.324 -176.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.459 ' HB1' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.507 -0.688 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -89.41 67.72 2.31 Favored 'Trans proline' 0 N--CA 1.432 -2.132 0 C-N-CA 122.015 1.81 . . . . 0.0 111.177 175.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 52.7 tp -59.0 84.25 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.792 0.806 . . . . 0.0 110.781 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 15.5 ptt? -81.96 -55.95 4.27 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.86 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.9 m -162.09 118.72 2.06 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.559 ' O ' HG13 ' A' ' 118' ' ' ILE . 2.5 pm0 -57.47 -34.82 69.41 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -173.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -69.9 -42.6 73.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 109.946 -178.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.32 -37.26 80.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.292 175.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.502 ' O ' HG13 ' A' ' 121' ' ' ILE . 11.7 tp -61.89 -36.45 81.32 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.956 177.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 114' ' ' GLU . 61.8 mt -57.7 -47.4 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.436 174.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -67.14 -27.01 66.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 176.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.472 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -69.66 -38.49 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.695 175.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.991 HD11 ' HA ' ' A' ' 94' ' ' SER . 76.1 mt -74.78 -18.29 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.536 0.684 . . . . 0.0 109.806 176.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.657 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 4.5 m-20 -75.35 -42.41 54.27 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 166.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.4 -38.26 68.83 Favored Glycine 0 C--O 1.227 -0.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.037 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.698 HG22 ' HB2' ' A' ' 128' ' ' ASP . 7.5 p -59.34 -49.19 84.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 117.468 0.634 . . . . 0.0 109.765 176.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.5 mt -69.89 -8.39 48.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.221 0.534 . . . . 0.0 111.269 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 39.7 mmt-85 -100.56 -31.91 11.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.499 -179.498 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.36 -48.9 0.78 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.698 ' HB2' HG22 ' A' ' 124' ' ' VAL . 32.8 m-20 -65.96 -25.99 67.36 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.492 0.663 . . . . 0.0 110.137 -177.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.823 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -72.42 90.8 1.32 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.924 -1.034 . . . . 0.0 108.735 168.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.465 ' HB3' ' HZ3' ' A' ' 130' ' ' LYS . 0.4 OUTLIER -77.84 -29.8 50.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.523 -169.008 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -90.86 -6.05 54.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.333 0.587 . . . . 0.0 111.024 -177.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.823 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 9.5 m120 55.95 49.46 15.8 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.353 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 p30 -95.22 -8.1 37.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.199 175.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 -1.3 85.49 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.45 177.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.546 ' HB2' HD11 ' A' ' 87' ' ' LEU . 24.1 m-85 -131.42 176.03 8.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 109.983 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.515 HD11 ' CG2' ' A' ' 124' ' ' VAL . 10.1 tt -112.09 118.7 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.796 0.808 . . . . 0.0 110.507 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -93.58 170.65 9.43 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.583 177.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.863 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.2 t80 -46.62 -54.94 8.46 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.061 0.544 . . . . 0.0 111.224 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.19 -25.88 68.54 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.021 0.439 . . . . 0.0 111.839 -176.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.505 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -77.81 -52.76 8.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.937 -175.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.863 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -72.64 -31.07 64.83 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.644 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.76 -40.54 79.98 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.889 0.376 . . . . 0.0 110.791 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -76.94 -29.25 55.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.333 177.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' SER . . . . . 0.403 ' HB3' HG12 ' A' ' 100' ' ' VAL . 22.7 t -82.8 -38.15 23.51 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.025 -170.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.813 HD22 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.662 -173.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.624 ' HB2' HD23 ' A' ' 72' ' ' LEU . 88.6 mmm . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.45 ' HG ' ' CD ' ' A' ' 71' ' ' GLU . 2.9 p -116.22 159.65 38.85 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 121.348 -0.141 . . . . 0.0 111.168 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.506 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 82.6 Cg_exo -49.33 -39.79 43.66 Favored 'Trans proline' 0 N--CA 1.481 0.741 0 C-N-CA 123.608 2.872 . . . . 0.0 115.511 -169.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.416 ' HA ' HE21 ' A' ' 73' ' ' GLN . 0.0 OUTLIER -57.56 -54.79 42.89 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 121.227 0.537 . . . . 0.0 110.648 -175.543 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.594 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 1.9 pm0 -76.99 -27.17 54.62 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.886 177.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.624 HD23 ' HB2' ' A' ' 67' ' ' MET . 14.0 mt -65.57 -17.56 64.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 120.875 0.369 . . . . 0.0 111.502 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.538 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 44.4 mt-30 -71.23 -47.93 54.28 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 171.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.5 -22.49 63.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.016 172.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.542 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 68.7 t60 -67.15 -37.07 83.15 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.329 176.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.515 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 3.8 m-30 -70.34 -34.62 72.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.483 0.659 . . . . 0.0 109.394 177.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.665 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 55.5 t80 -67.78 -52.3 38.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.913 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.665 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.2 mmmt -79.34 -14.81 58.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.381 -175.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.0 OUTLIER -45.33 -38.11 5.46 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 124.052 0.845 . . . . 0.0 111.816 -174.401 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -142.81 9.52 1.75 Allowed 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.713 178.955 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.477 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.7 t70 -85.21 79.51 9.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.863 0.84 . . . . 0.0 109.829 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 -11.22 24.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.7 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -90.14 -14.71 33.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.526 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.88 24.57 66.82 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.328 -0.851 . . . . 0.0 114.92 171.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -87.67 5.23 40.7 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.545 1.172 . . . . 0.0 111.012 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.533 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 11.3 m120 70.3 5.74 5.47 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.678 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 135' ' ' TYR . 3.7 mm? -121.22 145.56 47.72 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.296 0.57 . . . . 0.0 109.932 175.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.473 ' HB3' ' HG ' ' A' ' 93' ' ' LEU . 3.6 mm? -107.44 110.71 22.73 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.149 174.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.58 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.4 p30 -84.64 -174.1 5.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.189 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.08 -47.43 66.94 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.093 0.397 . . . . 0.0 114.093 -176.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.665 HD11 ' N ' ' A' ' 92' ' ' GLU . 3.8 pp -77.14 -28.16 54.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.599 0.699 . . . . 0.0 110.641 -175.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.665 ' N ' HD11 ' A' ' 91' ' ' LEU . 45.5 mt-10 -65.98 -55.08 18.57 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 172.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.924 ' HB3' HG12 ' A' ' 97' ' ' ILE . 32.7 mt -64.21 -12.58 42.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.198 -178.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.681 ' HA ' HD11 ' A' ' 121' ' ' ILE . 39.4 m -55.12 -34.13 63.45 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.595 0.236 . . . . 0.0 111.617 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -92.81 -31.49 15.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.19 0.519 . . . . 0.0 111.225 174.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.419 ' HB1' ' HA ' ' A' ' 93' ' ' LEU . . . -80.04 -42.31 24.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.222 -170.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.924 HG12 ' HB3' ' A' ' 93' ' ' LEU . 41.2 mm -62.7 -25.2 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 111.055 -176.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.622 HG23 ' HB2' ' A' ' 109' ' ' ALA . 2.7 m -58.69 -18.61 32.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.58 176.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.515 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 72.9 m-70 -115.51 -33.47 5.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.369 172.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.858 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 39.1 t -58.91 -55.46 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 40.2 t60 . . . . . 0 C--O 1.234 0.247 0 CA-C-O 121.436 0.636 . . . . 0.0 110.348 -177.617 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.622 ' HB2' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.507 -0.698 0 N-CA-C 110.491 -0.189 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -74.48 61.38 5.2 Favored 'Trans proline' 0 N--CA 1.448 -1.203 0 C-N-CA 121.904 1.736 . . . . 0.0 110.848 172.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.8 tp -71.67 74.54 0.82 Allowed 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 122.185 0.993 . . . . 0.0 110.578 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.403 ' C ' ' HG ' ' A' ' 113' ' ' SER . 10.0 ptt? -75.61 -53.61 8.31 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.268 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.403 ' HG ' ' C ' ' A' ' 112' ' ' MET . 49.0 m -159.86 122.9 3.52 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 175.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.573 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -61.09 -33.97 74.2 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -170.179 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.61 -40.71 76.46 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.215 0.531 . . . . 0.0 110.37 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.0 tt0 -68.85 -36.69 78.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.848 0.832 . . . . 0.0 109.56 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.484 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.4 tm? -63.94 -36.81 85.17 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.612 177.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.573 HG13 ' O ' ' A' ' 114' ' ' GLU . 70.1 mt -62.52 -38.95 82.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.669 174.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -64.5 -40.45 95.67 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 174.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.64 -39.35 79.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.595 175.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.819 ' HA ' HG23 ' A' ' 97' ' ' ILE . 76.0 mt -59.85 -47.91 89.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.284 175.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.782 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 34.7 t70 -61.49 -39.89 92.58 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.66 -31.21 52.97 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.873 175.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.762 HG22 HD11 ' A' ' 97' ' ' ILE . 42.9 t -68.25 -49.22 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.291 -0.262 . . . . 0.0 110.291 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 134' ' ' GLY . 8.8 mp -63.63 -10.34 18.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.018 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.782 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 24.2 mtm-85 -102.31 -49.24 3.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -113.45 -45.1 3.15 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -172.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.572 ' HB2' HG12 ' A' ' 124' ' ' VAL . 10.1 m-20 -68.91 -24.09 64.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.898 0.38 . . . . 0.0 110.682 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.538 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.9 t70 -74.68 93.52 2.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.88 0.847 . . . . 0.0 108.962 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -79.08 -18.88 52.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.167 -172.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -2.35 43.9 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.202 -171.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.3 t30 60.64 32.91 20.4 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.389 -177.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -99.0 -1.98 38.45 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 121.061 0.458 . . . . 0.0 110.067 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.443 ' O ' ' HG ' ' A' ' 125' ' ' LEU . . . 82.02 -24.42 4.65 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.735 -0.666 . . . . 0.0 113.35 173.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.516 ' HB2' HD11 ' A' ' 87' ' ' LEU . 18.5 m-85 -116.48 -179.19 3.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.932 0.396 . . . . 0.0 110.59 -176.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.697 HG12 ' HG3' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -110.82 129.73 65.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.388 0.613 . . . . 0.0 112.091 179.206 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.435 ' H ' ' HG2' ' A' ' 140' ' ' GLU . 12.2 t70 -103.11 168.09 9.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.473 172.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.869 ' HA ' ' CE2' ' A' ' 141' ' ' PHE . 21.5 t80 -50.86 -44.05 59.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.718 0.294 . . . . 0.0 110.834 -177.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.447 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -67.81 -31.31 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -173.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.697 ' HG3' HG12 ' A' ' 136' ' ' ILE . 12.7 pt-20 -91.19 -30.06 16.88 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.508 -169.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.869 ' CE2' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -76.11 -32.06 58.99 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.21 171.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . 0.405 ' N ' ' CD1' ' A' ' 141' ' ' PHE . . . -64.13 -43.02 96.57 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.407 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.0 mtmt -72.77 -28.78 62.81 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.351 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.3 t -70.04 -35.15 74.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.943 0.401 . . . . 0.0 110.274 -177.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.431 HD22 ' HG2' ' A' ' 73' ' ' GLN . 4.3 pp . . . . . 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.475 -177.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.788 ' HB2' HD23 ' A' ' 72' ' ' LEU . 98.2 mmm . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.715 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 26.6 m -98.4 139.4 21.15 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-O 120.997 0.427 . . . . 0.0 110.625 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.646 ' HA ' ' HB2' ' A' ' 72' ' ' LEU . 73.3 Cg_exo -50.92 -27.97 22.49 Favored 'Trans proline' 0 N--CA 1.477 0.51 0 C-N-CA 124.085 3.19 . . . . 0.0 115.15 -172.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -65.06 -51.32 62.18 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-O 120.731 0.301 . . . . 0.0 111.017 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.715 ' HG2' ' O ' ' A' ' 68' ' ' SER . 3.0 pm0 -72.33 -26.36 61.9 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.09 173.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.788 HD23 ' HB2' ' A' ' 67' ' ' MET . 39.5 mt -66.82 -17.5 64.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.688 0.28 . . . . 0.0 111.627 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.569 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 42.4 mt-30 -73.08 -40.97 64.58 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 171.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.2 tp -66.88 -21.88 65.99 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 171.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.579 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 5.0 t60 -66.91 -35.0 79.01 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.103 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 4.0 m-30 -72.1 -33.58 67.97 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.534 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 54.3 t80 -67.09 -53.08 34.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.154 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.531 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.9 mmmt -80.53 -11.12 59.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.596 -176.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.417 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 3.5 tpt -43.12 -43.41 4.47 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.069 0.856 . . . . 0.0 112.005 -172.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.519 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -141.06 10.06 2.14 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.88 179.332 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.735 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 34.2 t70 -82.07 80.7 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.31 0.576 . . . . 0.0 110.854 -176.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.519 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 3.9 m-85 -108.32 -6.11 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.738 178.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.5 p30 -75.8 -13.68 60.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.734 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.67 23.66 72.13 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 116.025 -0.534 . . . . 0.0 113.464 175.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -108.41 -8.65 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.616 0.708 . . . . 0.0 110.964 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.445 ' HB3' ' HZ ' ' A' ' 77' ' ' PHE . 13.1 m120 64.41 20.58 12.21 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.564 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 135' ' ' TYR . 2.9 mm? -127.89 157.04 41.6 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.544 ' HB3' ' HB2' ' A' ' 93' ' ' LEU . 83.2 mt -113.2 110.82 21.03 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.045 0.45 . . . . 0.0 111.537 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.525 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 8.0 t70 -83.31 161.45 21.42 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.565 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -44.59 -56.14 5.77 Favored Glycine 0 N--CA 1.464 0.514 0 N-CA-C 114.909 0.723 . . . . 0.0 114.909 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.677 HD11 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -73.55 -30.99 63.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.644 0.722 . . . . 0.0 111.262 -174.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.735 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.7 tt0 -69.61 -58.62 3.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.292 1.044 . . . . 0.0 108.768 176.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.917 ' HG ' HG12 ' A' ' 97' ' ' ILE . 40.7 tp -61.92 -10.44 9.5 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.755 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.775 ' HA ' HD11 ' A' ' 121' ' ' ILE . 18.8 m -51.94 -32.37 32.76 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.143 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.1 m -85.76 -27.34 25.28 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.531 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.527 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -85.17 -37.89 19.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -172.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.917 HG12 ' HG ' ' A' ' 93' ' ' LEU . 46.1 mm -64.3 -21.76 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 CA-C-O 120.902 0.382 . . . . 0.0 111.037 -177.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.592 HG23 ' HB1' ' A' ' 109' ' ' ALA . 4.2 m -57.58 -31.09 65.81 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.972 174.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.452 ' ND1' ' HB2' ' A' ' 109' ' ' ALA . 98.7 m-70 -101.42 -32.97 10.18 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.555 176.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.814 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 36.7 t -56.89 -52.42 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.486 0.184 . . . . 0.0 110.875 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 . . . . . 0 C--O 1.232 0.183 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.216 171.83 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.592 ' HB1' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.502 -0.878 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -83.04 67.1 7.79 Favored 'Trans proline' 0 N--CA 1.436 -1.862 0 C-N-CA 121.555 1.503 . . . . 0.0 111.305 175.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.22 79.61 0.05 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.368 1.08 . . . . 0.0 109.852 173.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.471 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.0 ptt? -92.15 -58.35 2.42 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 113.631 -1.622 . . . . 0.0 110.436 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.404 ' H ' ' CG ' ' A' ' 112' ' ' MET . 47.6 m -161.02 120.95 2.68 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.487 ' O ' HG13 ' A' ' 118' ' ' ILE . 9.2 pt-20 -56.39 -27.03 55.11 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -174.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.84 -47.18 78.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.375 0.607 . . . . 0.0 110.12 176.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.19 -38.8 85.97 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.435 HD13 ' HG1' ' A' ' 98' ' ' THR . 0.4 OUTLIER -60.65 -38.69 85.69 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.355 178.771 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 114' ' ' GLU . 30.9 mt -59.39 -50.62 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.517 174.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.2 -33.01 74.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.132 0.491 . . . . 0.0 110.357 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.2 mp -63.73 -45.68 96.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.01 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.823 ' HA ' HG23 ' A' ' 97' ' ' ILE . 71.7 mt -62.94 -44.94 99.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 121.141 0.496 . . . . 0.0 109.705 176.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.762 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.7 t70 -57.55 -44.55 85.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.429 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.46 -31.77 60.28 Favored Glycine 0 C--N 1.334 0.453 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.448 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.78 HG22 HD11 ' A' ' 97' ' ' ILE . 44.5 t -63.39 -51.62 68.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.271 173.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.62 -6.82 22.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.275 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.762 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 19.7 mtm180 -101.64 -47.77 4.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.045 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -115.56 -44.88 2.93 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.479 ' HB2' HG11 ' A' ' 124' ' ' VAL . 17.4 m-20 -70.96 -22.06 62.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.025 0.44 . . . . 0.0 111.049 -177.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -80.12 84.34 5.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -71.55 -26.65 62.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.756 -174.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . 0.475 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.6 m120 -76.45 -14.72 60.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.305 -173.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.7 t30 63.41 25.94 14.75 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.663 0.744 . . . . 0.0 109.221 -175.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . 0.475 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -92.47 -15.0 27.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.837 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.5 -25.34 28.43 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.9 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.525 ' CD2' ' HA ' ' A' ' 89' ' ' ASP . 14.2 m-85 -116.42 162.79 17.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.176 -176.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.523 HG23 ' HB2' ' A' ' 88' ' ' LEU . 7.3 tt -96.65 130.89 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.465 0.65 . . . . 0.0 110.263 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -103.02 172.03 7.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.53 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.802 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 11.2 t80 -53.25 -48.03 68.57 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 123.135 0.272 . . . . 0.0 110.752 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.408 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -64.44 -31.21 72.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.485 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -75.87 -52.43 10.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.573 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.802 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.0 p90 -70.16 -28.05 65.02 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.397 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.57 -40.37 96.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 120.941 0.401 . . . . 0.0 110.447 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.8 mtmt -74.14 -28.81 61.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.762 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 13.7 t -80.94 -33.86 33.72 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.97 -174.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.0 pp . . . . . 0 CA--C 1.533 0.3 0 O-C-N 122.336 -0.228 . . . . 0.0 111.502 -178.222 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.616 ' HE1' ' HG3' ' A' ' 71' ' ' GLU . 91.7 mmm . . . . . 0 N--CA 1.464 0.256 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.474 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -93.9 161.34 30.28 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.537 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 10.1 Cg_endo -52.29 -46.62 31.64 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.145 2.563 . . . . 0.0 113.82 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -61.63 -50.28 73.17 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.252 -172.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.616 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 7.8 pm0 -71.97 -28.94 63.76 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.398 176.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.498 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 13.0 mt -66.76 -21.13 66.07 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.3 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.537 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 24.8 mt-30 -69.35 -46.46 66.95 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 173.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.47 -21.93 66.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.757 172.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.65 ' CE1' ' HE3' ' A' ' 79' ' ' MET . 25.5 t60 -69.99 -44.29 69.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.175 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.602 ' HE2' ' CD2' ' A' ' 145' ' ' LEU . 5.3 m-30 -67.58 -26.82 66.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.527 0.68 . . . . 0.0 109.371 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.47 ' HA ' HD13 ' A' ' 88' ' ' LEU . 48.6 t80 -74.87 -52.61 10.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 114.526 -1.215 . . . . 0.0 109.989 179.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.574 ' HE3' ' HA ' ' A' ' 78' ' ' LYS . 19.7 mmmt -81.15 -24.63 37.44 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -174.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.65 ' HE3' ' CE1' ' A' ' 75' ' ' HIS . 18.2 tpp -44.84 -46.06 10.53 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -172.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.712 ' CD2' ' HB3' ' A' ' 92' ' ' GLU . 1.8 p-80 -130.26 8.28 5.08 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.578 -169.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.642 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 29.3 t70 -84.49 64.84 8.64 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.961 0.886 . . . . 0.0 109.357 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -95.66 3.29 54.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.627 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -89.27 -14.24 36.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.14 26.63 71.84 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.557 -0.747 . . . . 0.0 113.85 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -109.03 -1.74 18.68 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.714 0.757 . . . . 0.0 112.259 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 67.99 14.31 9.32 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.365 0.416 . . . . 0.0 111.512 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.496 HD11 ' HB2' ' A' ' 135' ' ' TYR . 1.8 mm? -126.35 155.25 42.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.654 HD23 ' NE2' ' A' ' 80' ' ' HIS . 17.8 mt -111.69 113.63 26.12 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.201 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.27 176.12 6.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.546 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.03 -51.88 47.03 Favored Glycine 0 CA--C 1.518 0.223 0 N-CA-C 114.238 0.455 . . . . 0.0 114.238 -178.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.596 HD11 ' N ' ' A' ' 92' ' ' GLU . 4.0 pp -73.81 -26.28 60.53 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.359 0.579 . . . . 0.0 110.77 -173.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.712 ' HB3' ' CD2' ' A' ' 80' ' ' HIS . 46.9 mt-10 -65.0 -54.8 24.69 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 122.112 0.958 . . . . 0.0 108.509 168.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 97' ' ' ILE . 57.1 mt -60.46 -10.04 4.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.077 -1.419 . . . . 0.0 112.53 -175.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.634 ' HA ' HD11 ' A' ' 121' ' ' ILE . 85.0 p -51.49 -33.08 29.93 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.54 0.525 . . . . 0.0 111.55 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -90.26 -33.33 16.18 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.505 ' HB2' ' HE1' ' A' ' 80' ' ' HIS . . . -93.96 -32.21 13.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -168.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.862 HG12 ' HB3' ' A' ' 93' ' ' LEU . 35.3 mm -65.4 -23.18 32.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.267 0.556 . . . . 0.0 110.445 -177.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.741 HG21 HD23 ' A' ' 117' ' ' LEU . 13.4 m -60.07 -17.84 42.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.9 174.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -110.59 -38.3 5.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.032 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.757 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 54.9 t -56.85 -59.53 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.116 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . 0.409 ' CD2' HG13 ' A' ' 120' ' ' ILE . 7.7 t60 . . . . . 0 N--CA 1.449 -0.499 0 CA-C-O 121.401 0.62 . . . . 0.0 109.423 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.508 -0.639 0 CA-C-O 120.506 0.193 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -91.38 69.37 1.1 Allowed 'Trans proline' 0 N--CA 1.435 -1.921 0 C-N-CA 122.231 1.954 . . . . 0.0 111.678 175.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.8 mt -51.1 93.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.669 0.747 . . . . 0.0 110.967 173.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -100.82 -55.29 2.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.623 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.7 m -160.74 118.28 2.43 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.496 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.7 OUTLIER -55.41 -36.64 66.67 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -174.541 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -67.57 -49.67 62.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.108 0.48 . . . . 0.0 110.154 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.28 -36.93 74.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.202 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.741 HD23 HG21 ' A' ' 98' ' ' THR . 9.8 tp -66.44 -41.09 89.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.323 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.2 mt -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.392 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -70.77 -31.47 68.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.431 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.409 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.0 OUTLIER -62.02 -38.54 81.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.273 175.911 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.835 ' HA ' HG23 ' A' ' 97' ' ' ILE . 80.1 mt -64.08 -41.6 92.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.914 176.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.697 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.1 t70 -62.3 -44.1 97.3 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.613 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.91 -30.24 56.65 Favored Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.492 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.802 HG23 HD11 ' A' ' 97' ' ' ILE . 42.7 t -63.67 -50.49 77.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.996 0.427 . . . . 0.0 110.362 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.27 -6.25 22.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.051 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.697 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 27.8 mtm-85 -98.88 -48.47 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.055 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -121.27 -39.65 2.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.534 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 21.6 m-20 -67.48 -21.89 65.49 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.031 0.443 . . . . 0.0 110.967 -178.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.521 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.7 t70 -76.1 92.64 3.23 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 166.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -78.96 -27.69 43.58 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.471 -168.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.51 4.84 36.34 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.974 -170.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.521 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 65.0 t30 57.35 53.29 7.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.133 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -108.49 -3.86 17.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.773 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.15 -18.9 37.92 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.94 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.496 ' HB2' HD11 ' A' ' 87' ' ' LEU . 48.8 m-85 -117.36 177.34 4.77 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.878 0.37 . . . . 0.0 110.025 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.501 HD12 ' HB3' ' A' ' 141' ' ' PHE . 6.3 tt -113.38 123.52 69.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.403 0.62 . . . . 0.0 109.492 174.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -101.62 -179.34 3.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.836 177.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.866 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 9.4 t80 -52.2 -51.19 59.65 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.579 0.549 . . . . 0.0 111.476 -173.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.54 -22.04 64.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -175.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 52.6 mt-10 -80.08 -50.8 9.83 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -174.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.866 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 5.0 p90 -71.44 -33.59 69.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.84 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.12 77.16 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.848 0.356 . . . . 0.0 110.821 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -73.08 -29.22 62.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.111 176.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 7.7 t -81.14 -18.9 44.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -174.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 91.3 mt . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.989 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.689 ' HB2' ' CD1' ' A' ' 72' ' ' LEU . 85.6 mmm . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.405 ' O ' HD11 ' A' ' 72' ' ' LEU . 14.8 m -96.69 153.45 38.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.166 177.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -49.36 -43.1 39.28 Favored 'Trans proline' 0 N--CA 1.479 0.657 0 C-N-CA 122.931 2.421 . . . . 0.0 113.573 -173.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -56.72 -44.87 82.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.055 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -64.93 -43.8 91.58 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.279 174.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.689 ' CD1' ' HB2' ' A' ' 67' ' ' MET . 7.7 mp -57.2 -24.8 56.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -169.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.601 ' HG2' HD23 ' A' ' 145' ' ' LEU . 10.2 mt-30 -63.9 -50.42 68.81 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 173.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 34.2 tp -63.49 -24.07 67.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.011 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.559 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 13.7 t60 -66.62 -38.25 86.54 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 4.3 m-30 -71.92 -37.02 70.13 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.643 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 48.7 t80 -62.16 -52.75 62.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.943 178.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -80.24 -13.66 59.05 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.57 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.63 -45.83 9.8 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 124.044 0.84 . . . . 0.0 111.069 -171.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.492 ' CD2' ' HE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -139.54 9.97 2.46 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.966 -178.634 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.744 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 26.2 t70 -85.07 82.96 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.892 0.853 . . . . 0.0 109.758 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.492 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.7 OUTLIER -121.63 15.17 11.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.144 -177.254 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -95.12 -13.33 25.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.219 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 12.14 80.59 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.249 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -98.34 -4.15 35.55 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 117.394 0.597 . . . . 0.0 111.065 -178.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 58.38 34.4 23.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.605 176.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' A' ' 135' ' ' TYR . 7.9 mt -151.54 149.37 29.12 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.563 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.543 HD12 ' HA ' ' A' ' 77' ' ' PHE . 68.8 mt -94.81 113.21 24.94 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.973 0.416 . . . . 0.0 111.823 -177.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.48 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 8.9 t70 -91.71 167.0 12.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.391 177.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.86 -49.93 39.82 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.648 HD11 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -68.92 -29.22 67.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 117.413 0.606 . . . . 0.0 110.631 -176.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.744 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 50.8 mt-10 -69.83 -48.54 58.58 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.815 ' HB3' HG12 ' A' ' 97' ' ' ILE . 25.2 mt -65.26 -11.24 39.3 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.31 -178.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.647 ' HA ' HD11 ' A' ' 121' ' ' ILE . 65.9 m -58.46 -33.35 69.65 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.832 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -93.35 -27.67 16.63 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.217 0.532 . . . . 0.0 111.482 174.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.51 -41.43 14.36 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -169.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.838 HG23 ' HA ' ' A' ' 121' ' ' ILE . 43.0 mm -64.43 -21.13 28.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.012 0.434 . . . . 0.0 110.692 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.635 HG21 HD22 ' A' ' 117' ' ' LEU . 2.6 m -58.12 -21.95 48.83 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.54 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 80.6 m-70 -115.16 -6.2 12.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.322 176.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.717 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 42.0 t -90.13 -46.39 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 120.771 0.32 . . . . 0.0 111.432 -179.987 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.528 ' HA ' ' O ' ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.512 -0.513 0 CA-C-O 120.343 0.116 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.78 72.56 6.46 Favored 'Trans proline' 0 N--CA 1.444 -1.42 0 C-N-CA 122.083 1.855 . . . . 0.0 111.795 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.425 HD23 ' HB1' ' A' ' 109' ' ' ALA . 2.8 mm? -62.23 80.44 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.921 0.867 . . . . 0.0 110.383 169.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -98.94 -60.51 1.52 Allowed 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.668 -178.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.8 m -165.6 120.19 1.24 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.07 -35.29 66.8 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -172.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.2 -46.79 88.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.217 0.532 . . . . 0.0 110.544 179.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.03 -33.65 63.83 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.115 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.635 HD22 HG21 ' A' ' 98' ' ' THR . 17.0 tp -61.25 -39.01 88.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.998 175.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 51.3 mt -61.38 -44.01 97.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.129 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -68.27 -33.13 73.79 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.395 0.617 . . . . 0.0 110.331 176.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.48 -40.53 84.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.416 174.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.838 ' HA ' HG23 ' A' ' 97' ' ' ILE . 90.3 mt -61.79 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.146 177.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.762 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.7 t70 -58.7 -44.43 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.556 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.87 -33.89 50.59 Favored Glycine 0 C--N 1.332 0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.184 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.726 HG23 HD11 ' A' ' 97' ' ' ILE . 39.8 t -63.0 -53.84 41.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.582 0.23 . . . . 0.0 110.872 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.514 HD13 HD13 ' A' ' 93' ' ' LEU . 9.0 mp -63.95 -14.52 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.967 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.762 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.4 mtm180 -95.0 -50.14 5.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.251 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -117.7 -41.3 2.94 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -170.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.511 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -68.1 -18.79 64.75 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.523 0.678 . . . . 0.0 109.669 178.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.61 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 3.2 t70 -72.34 90.68 1.29 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.693 165.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -79.51 -16.85 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.276 -170.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -113.4 13.36 18.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -171.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.8 t30 53.8 50.11 17.67 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.27 173.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -110.9 -9.02 14.46 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.553 -0.459 . . . . 0.0 109.997 173.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 79.72 0.78 85.68 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.524 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.438 ' HB2' HD23 ' A' ' 87' ' ' LEU . 87.2 m-85 -126.08 175.35 7.81 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.499 HD11 ' CG1' ' A' ' 124' ' ' VAL . 10.2 tt -118.56 121.11 66.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.421 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -99.92 -176.87 3.37 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.308 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.841 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.2 t80 -53.41 -50.2 65.69 Favored 'General case' 0 C--O 1.225 -0.227 0 O-C-N 123.66 0.6 . . . . 0.0 111.812 -173.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.79 -35.14 78.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.768 0.318 . . . . 0.0 110.756 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.61 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 48.9 mt-10 -66.21 -53.79 32.94 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.815 -174.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.841 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -73.08 -32.03 64.74 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.798 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.61 97.73 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.124 0.487 . . . . 0.0 110.117 178.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -70.09 -29.03 65.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.927 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 9.6 t -82.45 -32.78 28.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.608 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.601 HD23 ' HG2' ' A' ' 73' ' ' GLN . 4.5 pp . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 121.205 0.526 . . . . 0.0 111.065 -179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.63 ' HB2' HD23 ' A' ' 72' ' ' LEU . 97.7 mmm . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 110.45 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.469 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 49.1 m -97.79 161.96 23.95 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.324 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.506 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.8 Cg_exo -50.83 -46.48 30.18 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.94 2.426 . . . . 0.0 114.57 -172.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -59.6 -49.23 78.55 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.509 ' HG3' ' HE2' ' A' ' 67' ' ' MET . 1.6 pm0 -78.35 -26.13 46.6 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 122.048 -0.407 . . . . 0.0 111.121 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.63 HD23 ' HB2' ' A' ' 67' ' ' MET . 11.8 mt -64.41 -20.02 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.524 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 29.6 mt-30 -73.35 -43.04 61.51 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 51.5 tp -65.61 -23.82 66.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.715 173.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.5 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 46.3 t60 -64.3 -37.29 86.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 176.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -69.26 -35.31 75.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.629 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.576 ' HD1' ' HE2' ' A' ' 141' ' ' PHE . 62.9 t80 -68.72 -50.33 51.67 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.514 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -80.05 -13.71 59.1 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.361 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.416 ' HE2' ' HA ' ' A' ' 79' ' ' MET . 0.6 OUTLIER -45.06 -41.29 7.49 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.94 0.775 . . . . 0.0 112.937 -172.035 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -141.49 10.52 2.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.904 -178.052 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.673 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 23.5 t70 -82.83 81.93 8.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.823 0.82 . . . . 0.0 109.681 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.56 15.62 18.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.723 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.0 p30 -99.69 -13.14 19.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.88 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 71.2 29.42 68.63 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.021 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -106.83 -3.58 20.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.477 0.638 . . . . 0.0 111.342 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 60.65 42.42 13.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.586 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.492 HD23 ' HB2' ' A' ' 135' ' ' TYR . 6.0 mt -158.3 153.56 25.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.419 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 77' ' ' PHE . 96.4 mt -106.15 113.34 26.82 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.912 0.387 . . . . 0.0 111.29 178.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.508 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 16.8 t70 -87.33 157.57 19.25 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.744 172.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -46.93 -35.74 8.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.671 -177.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.508 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 36.0 mt -65.42 -40.71 93.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.975 0.417 . . . . 0.0 111.656 -178.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.673 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 27.9 mt-10 -74.6 -44.22 51.79 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.549 1.166 . . . . 0.0 108.82 172.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.906 ' HG ' HG12 ' A' ' 97' ' ' ILE . 10.7 tp -63.77 -12.97 39.81 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 113.286 -1.779 . . . . 0.0 111.917 -169.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.857 ' HA ' HD11 ' A' ' 121' ' ' ILE . 40.9 p -51.82 -48.77 63.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.419 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -78.29 -26.94 47.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.205 0.526 . . . . 0.0 111.397 -176.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.54 ' HB1' HD11 ' A' ' 93' ' ' LEU . . . -80.98 -42.5 21.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.657 -173.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.906 HG12 ' HG ' ' A' ' 93' ' ' LEU . 45.1 mm -66.05 -17.41 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.043 0.449 . . . . 0.0 111.151 -177.303 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.575 HG21 HD22 ' A' ' 117' ' ' LEU . 2.0 m -63.69 -15.13 57.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 175.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -115.58 -32.98 5.37 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.449 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.778 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.3 t -59.86 -53.78 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.77 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 32.6 t-80 . . . . . 0 C--O 1.234 0.241 0 CA-C-O 121.001 0.429 . . . . 0.0 110.499 178.479 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.535 ' HB1' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.509 -0.625 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . 0.415 ' O ' ' HG2' ' A' ' 112' ' ' MET . 7.4 Cg_exo -73.29 60.31 3.97 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.364 2.043 . . . . 0.0 111.68 177.058 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.66 77.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.114 0.959 . . . . 0.0 110.979 174.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.42 ' H ' ' HG2' ' A' ' 112' ' ' MET . 8.0 ptt? -95.44 -59.1 1.95 Allowed 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.718 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.3 m -160.59 118.58 2.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.505 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.0 pt-20 -52.54 -37.02 56.79 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -172.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -66.3 -42.05 88.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.979 0.418 . . . . 0.0 110.471 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -75.35 -29.06 59.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.315 178.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.575 HD22 HG21 ' A' ' 98' ' ' THR . 13.8 tp -65.0 -38.54 91.3 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 173.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 114' ' ' GLU . 90.6 mt -62.07 -43.1 97.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.249 172.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -63.43 -34.96 78.88 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.084 0.469 . . . . 0.0 110.407 175.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -39.56 85.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.38 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.857 HD11 ' HA ' ' A' ' 94' ' ' SER . 78.5 mt -66.27 -41.78 89.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.429 0.633 . . . . 0.0 109.865 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.802 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 29.6 t70 -62.33 -44.25 96.92 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.666 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.475 ' HA3' ' HD3' ' A' ' 126' ' ' ARG . . . -54.3 -34.37 53.86 Favored Glycine 0 C--N 1.334 0.46 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.998 176.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.818 HG22 HD11 ' A' ' 97' ' ' ILE . 39.0 t -59.07 -53.41 48.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.886 0.375 . . . . 0.0 110.196 172.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 62.7 mt -68.46 -0.77 5.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.618 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.802 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.9 mtp180 -103.43 -47.98 4.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.681 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -121.38 -38.23 2.81 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -173.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.526 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -75.77 -16.49 60.12 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.192 0.52 . . . . 0.0 110.805 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.598 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.5 t70 -78.9 87.24 4.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 169.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -74.88 -32.79 61.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.139 -168.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.98 -3.09 58.95 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.609 -176.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.598 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 18.7 m120 60.71 43.24 12.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.018 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.1 p30 -98.17 -12.58 21.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.358 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.68 4.29 89.05 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.335 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.492 ' HB2' HD23 ' A' ' 87' ' ' LEU . 59.2 m-85 -129.56 -179.85 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 175.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.489 HD12 ' HB3' ' A' ' 141' ' ' PHE . 8.9 tt -120.81 120.74 63.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.43 0.633 . . . . 0.0 110.142 174.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -97.22 -178.09 4.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.815 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 21.5 t80 -55.21 -49.04 72.97 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.413 0.446 . . . . 0.0 111.669 -172.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.64 -31.49 71.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.489 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.517 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.7 mt-10 -68.69 -51.26 43.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.404 -176.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.815 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.8 p90 -74.98 -32.48 61.69 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.734 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -61.08 -45.45 94.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.956 0.408 . . . . 0.0 110.074 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -65.62 -30.15 70.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.22 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 8.0 t -82.67 -37.01 25.43 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.831 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 3.8 pp . . . . . 0 N--CA 1.463 0.217 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.206 -176.431 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.601 ' HE3' ' HA ' ' A' ' 72' ' ' LEU . 51.8 mtp . . . . . 0 CA--C 1.52 -0.177 0 CA-C-O 121.057 0.455 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.472 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 3.9 m -91.44 152.91 44.11 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.738 177.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.58 -49.05 18.8 Favored 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.237 1.958 . . . . 0.0 113.698 -176.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.497 ' HA ' HE21 ' A' ' 73' ' ' GLN . 19.0 pt20 -60.42 -41.02 93.1 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.451 -175.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 68' ' ' SER . 12.9 pt-20 -75.74 -33.94 60.28 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.751 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.623 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -64.95 -21.68 66.87 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.329 0.585 . . . . 0.0 111.309 -174.532 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.497 HE21 ' HA ' ' A' ' 70' ' ' GLN . 46.6 mt-30 -73.09 -43.47 61.76 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 175.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.59 -20.86 66.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.911 172.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.623 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 39.0 t60 -64.65 -44.1 91.51 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 120.856 0.36 . . . . 0.0 110.348 175.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.727 ' CD1' HG21 ' A' ' 100' ' ' VAL . 3.8 m-30 -66.34 -25.97 67.07 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.24 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.738 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.6 t80 -74.17 -53.75 9.2 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.297 177.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.738 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.4 mmmt -80.63 -12.72 59.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.331 -173.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.485 ' HG2' ' HA ' ' A' ' 96' ' ' ALA . 1.0 OUTLIER -45.51 -35.69 4.03 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.981 0.801 . . . . 0.0 112.244 -174.149 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.79 10.58 1.06 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.554 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 30.1 t70 -84.55 81.71 8.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.909 0.861 . . . . 0.0 110.337 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -99.31 -6.88 27.16 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.286 177.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -95.8 -14.52 23.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.614 -174.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 66.37 23.96 72.01 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 114.911 0.724 . . . . 0.0 114.911 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -84.47 3.54 35.84 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.299 1.049 . . . . 0.0 111.026 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.617 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 29.2 m-80 59.52 28.0 17.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.531 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.0 mt -148.99 167.45 25.77 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.958 177.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 77' ' ' PHE . 13.0 mt -135.26 122.08 21.04 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.201 -179.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -103.67 -170.52 1.79 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -51.21 -38.67 40.85 Favored Glycine 0 CA--C 1.521 0.468 0 O-C-N 123.399 0.437 . . . . 0.0 113.978 -174.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.2 mt -67.75 -41.25 83.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.354 0.597 . . . . 0.0 111.09 -175.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.554 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 40.1 mt-10 -74.69 -45.79 42.05 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.624 0.726 . . . . 0.0 109.886 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.731 HD23 HG23 ' A' ' 136' ' ' ILE . 21.7 mt -63.92 -20.36 65.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.98 -1.009 . . . . 0.0 113.148 -172.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.759 ' HA ' HD11 ' A' ' 121' ' ' ILE . 53.4 p -53.53 -36.7 62.08 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.735 0.302 . . . . 0.0 111.624 -177.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -90.04 -33.4 16.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 0.0 111.141 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.577 ' O ' HG22 ' A' ' 100' ' ' VAL . . . -80.16 -47.47 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.738 -171.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.807 HD11 HG23 ' A' ' 124' ' ' VAL . 36.5 mm -59.44 -22.75 23.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.612 -174.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.772 HG21 HD23 ' A' ' 117' ' ' LEU . 18.5 m -58.88 -18.24 31.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.308 175.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -113.96 -17.27 12.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.403 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.727 HG21 ' CD1' ' A' ' 76' ' ' TYR . 2.4 t -88.27 -51.6 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.138 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . 0.488 ' CD2' HG13 ' A' ' 120' ' ' ILE . 52.7 t60 . . . . . 0 C--N 1.332 -0.194 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.861 -177.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.624 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -83.11 64.36 7.86 Favored 'Trans proline' 0 N--CA 1.439 -1.72 0 C-N-CA 122.03 1.82 . . . . 0.0 110.874 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 46.8 tp -63.08 81.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 122.002 0.906 . . . . 0.0 111.054 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.44 ' H ' ' HG2' ' A' ' 112' ' ' MET . 8.9 ptt? -89.62 -56.09 3.39 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.366 178.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.6 m -159.8 123.57 3.7 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 177.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.57 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.51 -40.86 65.74 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.742 -172.505 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.414 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 34.1 t70 -71.12 -39.88 71.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -67.48 -37.15 82.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.355 0.598 . . . . 0.0 109.597 174.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.772 HD23 HG21 ' A' ' 98' ' ' THR . 11.9 tp -61.86 -32.87 73.26 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.048 177.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.57 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.7 mt -62.78 -43.96 99.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.416 174.109 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . 0.498 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 16.6 m120 -69.02 -24.17 64.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.183 0.516 . . . . 0.0 110.607 176.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.488 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -66.07 -39.0 83.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.575 0.702 . . . . 0.0 109.505 173.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.763 ' HA ' HG23 ' A' ' 97' ' ' ILE . 80.1 mt -68.5 -38.76 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.379 174.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.602 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 94.4 m-20 -53.41 -49.55 67.04 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.732 172.041 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.81 -34.23 36.76 Favored Glycine 0 CA--C 1.508 -0.354 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.981 178.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.807 HG23 HD11 ' A' ' 97' ' ' ILE . 76.7 t -68.0 -51.78 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-O 120.801 0.334 . . . . 0.0 110.939 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.404 HD23 HD13 ' A' ' 93' ' ' LEU . 54.6 mt -67.72 -11.47 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.948 -177.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.602 ' NH1' ' HB3' ' A' ' 122' ' ' ASP . 48.8 mtt180 -105.64 -32.18 8.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.5 -177.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -132.18 -44.62 0.94 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -171.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.569 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 39.7 m-20 -71.62 -19.72 62.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.693 0.282 . . . . 0.0 111.468 -176.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.504 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -77.06 99.72 5.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 167.422 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -80.87 -19.08 45.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.904 -170.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 -3.65 29.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.549 -171.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 66.68 33.06 6.59 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.427 0.454 . . . . 0.0 111.376 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -97.08 -8.77 29.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.108 0.48 . . . . 0.0 110.056 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . 0.414 ' C ' ' HD2' ' A' ' 135' ' ' TYR . . . 79.97 -8.56 50.3 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.946 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.414 ' HD2' ' C ' ' A' ' 134' ' ' GLY . 5.3 m-30 -115.58 167.09 11.21 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.731 HG23 HD23 ' A' ' 93' ' ' LEU . 8.1 tt -111.76 118.2 57.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.792 0.806 . . . . 0.0 110.436 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -88.13 168.84 12.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.067 177.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.811 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.0 t80 -50.43 -47.67 56.57 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 123.084 0.24 . . . . 0.0 110.406 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.16 75.15 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 120.757 0.313 . . . . 0.0 111.379 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.504 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 45.3 mt-10 -68.68 -54.86 13.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.444 -176.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.811 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -70.72 -30.54 67.1 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.49 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . 0.463 ' O ' ' HG ' ' A' ' 145' ' ' LEU . . . -61.69 -50.23 73.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 176.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -63.82 -32.39 73.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.099 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 15.9 t -77.7 -28.59 51.05 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.385 -177.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.495 HD23 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp . . . . . 0 CA--C 1.53 0.194 0 O-C-N 122.412 -0.18 . . . . 0.0 111.107 -179.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.685 ' HB2' HD22 ' A' ' 72' ' ' LEU . 89.6 mmm . . . . . 0 N--CA 1.461 0.115 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.494 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -88.43 153.09 50.59 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.297 0.094 . . . . 0.0 111.196 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.89 -44.02 43.94 Favored 'Trans proline' 0 N--CA 1.476 0.492 0 C-N-CA 123.307 2.671 . . . . 0.0 114.701 -170.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -59.48 -49.06 79.23 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.741 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -74.5 -26.27 59.9 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.586 175.937 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.685 HD22 ' HB2' ' A' ' 67' ' ' MET . 17.2 mt -63.34 -18.89 64.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.401 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 17.6 mt-30 -71.71 -45.43 61.85 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.43 -21.02 66.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.566 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.57 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 7.9 t60 -66.9 -40.31 87.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.106 177.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.603 ' HE2' ' CD2' ' A' ' 145' ' ' LEU . 5.9 m-30 -68.39 -32.99 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.539 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 57.3 t80 -71.02 -51.17 26.94 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.296 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -80.56 -16.91 53.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.868 -175.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.551 ' HE1' ' CE1' ' A' ' 75' ' ' HIS . 13.0 tpp -44.35 -48.69 9.72 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.646 0.591 . . . . 0.0 112.404 -172.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.728 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -130.68 10.22 5.11 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.88 -175.584 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.715 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 26.5 t70 -80.47 75.15 7.33 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.68 0.752 . . . . 0.0 110.005 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -91.53 -15.27 28.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.122 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.6 p30 -76.41 -14.24 60.08 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 -177.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.82 30.57 77.49 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.483 -0.78 . . . . 0.0 113.065 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -101.36 3.45 40.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 117.294 0.547 . . . . 0.0 111.229 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 64.15 34.51 10.98 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.335 0.588 . . . . 0.0 110.479 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.496 ' HB3' ' CD2' ' A' ' 135' ' ' TYR . 15.6 mt -157.23 158.33 35.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.88 178.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.494 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 88.3 mt -120.15 121.43 38.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.82 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.46 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 0.6 OUTLIER -92.24 -177.45 4.66 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.399 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -55.85 -37.09 68.36 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.295 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.46 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 26.0 mt -68.66 -47.75 65.73 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.141 0.496 . . . . 0.0 110.368 -177.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.728 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 45.2 mt-10 -64.11 -42.23 96.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.87 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.749 HD23 HG23 ' A' ' 136' ' ' ILE . 24.1 mt -66.55 -18.39 65.34 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.792 -175.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.623 ' HA ' ' CD1' ' A' ' 121' ' ' ILE . 46.4 t -57.1 -32.06 65.91 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.689 0.28 . . . . 0.0 111.048 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.88 -31.01 15.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.069 0.461 . . . . 0.0 111.188 178.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.57 -43.73 12.46 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.823 HG23 ' HA ' ' A' ' 121' ' ' ILE . 39.7 mm -64.77 -25.91 38.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -175.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.679 HG23 ' HB1' ' A' ' 109' ' ' ALA . 17.9 m -58.47 -20.27 43.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.724 174.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.494 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 68.3 m-70 -109.44 -27.07 9.66 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 173.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.759 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 38.4 t -67.48 -58.66 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.719 0.295 . . . . 0.0 111.173 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 12.4 t60 . . . . . 0 N--CA 1.452 -0.325 0 CA-C-O 121.364 0.602 . . . . 0.0 110.026 -177.831 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.679 ' HB1' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.505 -0.762 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -78.19 65.99 8.37 Favored 'Trans proline' 0 N--CA 1.443 -1.486 0 C-N-CA 121.745 1.63 . . . . 0.0 111.228 177.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.62 81.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.864 0.84 . . . . 0.0 111.095 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.433 ' CG ' ' H ' ' A' ' 113' ' ' SER . 14.4 ptt? -98.23 -57.81 2.12 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.005 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.433 ' H ' ' CG ' ' A' ' 112' ' ' MET . 73.6 m -162.39 124.58 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.512 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.25 -37.88 65.18 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.132 -173.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.78 -43.93 82.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.026 0.441 . . . . 0.0 110.662 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.08 -39.73 86.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.344 0.592 . . . . 0.0 109.932 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.61 HD12 HG21 ' A' ' 98' ' ' THR . 10.8 mt -62.66 -37.67 87.33 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.99 175.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 114' ' ' GLU . 63.6 mt -60.82 -42.98 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.032 0.444 . . . . 0.0 110.619 172.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -67.36 -29.81 69.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.222 0.534 . . . . 0.0 110.479 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.407 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.0 OUTLIER -65.57 -34.49 70.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.885 174.656 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.823 ' HA ' HG23 ' A' ' 97' ' ' ILE . 88.4 mt -67.26 -38.34 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.8 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.809 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.9 t70 -60.79 -46.0 92.21 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.232 176.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.56 -37.75 41.91 Favored Glycine 0 C--N 1.334 0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.007 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.767 HG23 HD11 ' A' ' 97' ' ' ILE . 54.8 t -63.58 -51.04 75.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 110.417 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.8 mt -65.02 -7.48 12.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.45 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.809 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 13.6 mtm180 -106.42 -49.33 3.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.847 0.356 . . . . 0.0 110.791 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -113.13 -44.19 3.29 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -169.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.495 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 27.3 m-20 -71.8 -23.89 61.64 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.151 0.5 . . . . 0.0 110.028 -177.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.578 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 4.6 t70 -76.05 88.22 2.98 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 168.006 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . 0.518 ' HB3' ' HZ3' ' A' ' 130' ' ' LYS . 0.2 OUTLIER -75.5 -21.51 57.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.477 -169.555 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -108.14 6.46 26.85 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.168 -170.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.444 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 44.1 m-80 58.41 38.96 25.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 175.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.9 p30 -96.74 -13.27 22.8 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.308 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.18 2.69 90.45 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.312 178.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.496 ' CD2' ' HB3' ' A' ' 87' ' ' LEU . 28.5 m-85 -124.7 173.43 8.55 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.749 HG23 HD23 ' A' ' 93' ' ' LEU . 6.7 tt -116.18 123.41 71.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.5 p30 -101.03 -179.69 4.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.833 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 4.3 t80 -53.65 -50.31 66.05 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 123.558 0.537 . . . . 0.0 111.209 -174.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.63 -20.43 64.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.68 -176.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.578 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -80.12 -52.92 7.19 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 -176.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.833 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -70.14 -33.31 71.63 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.274 178.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.37 -41.23 93.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.845 0.355 . . . . 0.0 110.732 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.7 mtmm -70.69 -28.44 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.931 176.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 14.9 t -80.87 -17.33 51.03 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -175.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.746 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 85.8 mt . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.419 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.698 ' HE1' ' HG3' ' A' ' 71' ' ' GLU . 94.0 mmm . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.17 158.38 39.33 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-O 119.635 -0.221 . . . . 0.0 110.48 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.591 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 9.6 Cg_endo -52.34 -43.34 54.64 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.904 2.403 . . . . 0.0 113.618 -173.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -54.03 51.38 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.933 -175.129 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.698 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 6.8 pm0 -72.36 -28.76 63.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.679 177.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.762 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 25.7 mt -63.87 -19.7 65.27 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.965 0.412 . . . . 0.0 110.938 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.795 ' HG2' HD23 ' A' ' 145' ' ' LEU . 17.8 mt-30 -66.15 -39.32 89.72 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 174.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.512 ' HG ' ' HG2' ' A' ' 78' ' ' LYS . 30.8 tp -77.22 -19.17 57.03 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.835 173.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.762 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 19.7 t60 -73.32 -38.67 65.74 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.668 ' CD2' HG21 ' A' ' 100' ' ' VAL . 6.9 m-30 -68.14 -41.61 81.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.035 175.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.644 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 50.0 t80 -66.37 -52.64 44.7 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.522 -175.551 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.644 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.6 mmmt -77.71 -15.77 58.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.989 -175.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.4 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 35.4 tpp -45.39 -44.87 12.28 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 123.84 0.712 . . . . 0.0 111.883 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.577 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -132.48 7.68 4.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.404 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.481 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 24.0 t70 -92.75 85.35 5.19 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.832 0.825 . . . . 0.0 109.487 178.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.528 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 23.0 m-85 -96.64 -8.89 30.48 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.209 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -88.63 -16.37 32.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.732 -175.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.72 28.17 65.13 Favored Glycine 0 CA--C 1.524 0.637 0 CA-C-N 115.886 -0.597 . . . . 0.0 113.764 176.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' ' 86' ' ' ASN . 18.9 p-10 -95.44 18.1 13.31 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 117.412 0.606 . . . . 0.0 111.5 -174.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.439 ' HB3' ' O ' ' A' ' 85' ' ' ASN . 4.3 t-20 76.48 -27.09 0.18 Allowed 'General case' 0 N--CA 1.47 0.557 0 O-C-N 123.782 0.676 . . . . 0.0 112.046 175.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.523 HD11 ' HB2' ' A' ' 135' ' ' TYR . 2.6 mm? -112.81 162.63 15.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.105 0.955 . . . . 0.0 112.459 -176.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.477 ' CB ' HD12 ' A' ' 93' ' ' LEU . 1.3 mt -132.26 123.38 26.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.612 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.427 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.0 p-10 -96.25 175.44 6.44 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.41 -37.32 12.14 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 114.108 0.403 . . . . 0.0 114.108 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.427 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 54.6 mt -65.13 -52.52 54.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.468 0.634 . . . . 0.0 110.707 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.577 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 43.9 mt-10 -61.47 -54.67 40.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.307 1.051 . . . . 0.0 109.33 174.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.97 ' HG ' HG12 ' A' ' 97' ' ' ILE . 5.5 tp -66.45 -9.82 37.99 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.836 -1.529 . . . . 0.0 112.917 -166.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.999 ' HA ' HD11 ' A' ' 121' ' ' ILE . 58.8 p -56.13 -45.32 79.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 111.343 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -23.53 51.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.218 0.532 . . . . 0.0 111.188 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.577 ' O ' HG22 ' A' ' 100' ' ' VAL . . . -86.42 -58.38 2.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.37 -175.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.97 HG12 ' HG ' ' A' ' 93' ' ' LEU . 24.4 mm -61.85 -20.36 23.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.281 -172.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.733 HG21 HD22 ' A' ' 117' ' ' LEU . 99.3 m -53.33 -31.52 44.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.081 0.467 . . . . 0.0 110.832 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 57.3 m-70 -94.82 -37.16 11.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.112 0.482 . . . . 0.0 110.823 176.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.933 HG23 ' HE1' ' A' ' 141' ' ' PHE . 2.1 t -72.57 -50.93 31.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.033 -170.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . 0.566 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.7 t60 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.494 ' HB2' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.506 -0.737 0 CA-C-O 120.479 0.181 . . . . 0.0 111.012 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . 0.544 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.1 Cg_endo -77.78 67.37 7.97 Favored 'Trans proline' 0 N--CA 1.445 -1.373 0 C-N-CA 121.422 1.415 . . . . 0.0 111.492 174.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.55 80.69 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.886 0.85 . . . . 0.0 111.33 173.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 12.2 ptt? -86.59 -56.81 3.25 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.244 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.0 m -163.7 126.36 2.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.427 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -51.15 -38.91 54.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.554 -174.052 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.3 -50.44 65.68 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.048 0.451 . . . . 0.0 111.068 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -64.61 -35.05 79.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.524 0.678 . . . . 0.0 109.946 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.733 HD22 HG21 ' A' ' 98' ' ' THR . 15.7 tp -65.09 -41.62 94.82 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.368 178.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 114' ' ' GLU . 55.0 mt -61.56 -42.1 92.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.581 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . 0.423 ' O ' ' HB3' ' A' ' 122' ' ' ASP . 91.8 m-20 -71.62 -23.92 61.79 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.218 0.533 . . . . 0.0 110.71 176.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.566 HG13 ' CD2' ' A' ' 101' ' ' HIS . 0.9 OUTLIER -68.31 -33.66 61.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.303 0.573 . . . . 0.0 109.935 174.065 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.999 HD11 ' HA ' ' A' ' 94' ' ' SER . 58.8 mt -75.16 -17.69 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 121.636 0.731 . . . . 0.0 109.861 174.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.669 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 19.9 t70 -75.44 -36.76 60.69 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.37 -37.27 80.65 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.671 -1.15 . . . . 0.0 113.148 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.634 HG13 ' O ' ' A' ' 121' ' ' ILE . 7.2 p -60.46 -43.34 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 CA-C-N 117.555 0.677 . . . . 0.0 109.97 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.24 -13.82 62.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.082 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.669 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 28.6 mtm-85 -99.22 -50.1 4.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.563 -178.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -119.07 -20.98 7.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -168.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.562 ' CG ' ' HG ' ' A' ' 144' ' ' SER . 41.5 m-20 -89.89 -27.89 19.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.423 178.491 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.487 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -77.68 94.41 4.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.639 0.733 . . . . 0.0 109.316 172.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -80.42 -32.38 37.4 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.217 -0.902 . . . . 0.0 111.462 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.1 -0.18 56.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.676 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.487 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 73.5 m-20 63.88 28.08 14.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.7 176.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.8 p30 -84.06 -13.58 52.73 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.993 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 86.26 1.36 86.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.561 176.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.523 ' HB2' HD11 ' A' ' 87' ' ' LEU . 33.4 m-85 -130.54 176.41 8.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.45 HD12 ' CD1' ' A' ' 141' ' ' PHE . 6.3 tt -111.01 123.57 67.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.269 174.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.97 167.79 11.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.963 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -51.9 -41.2 61.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.605 0.184 . . . . 0.0 111.397 -178.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.78 -44.58 92.96 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.733 0.301 . . . . 0.0 110.693 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.429 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 46.5 mt-10 -67.13 -41.47 86.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.933 ' HE1' HG23 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -59.99 -54.77 42.12 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.496 178.013 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . 0.531 ' O ' ' HG ' ' A' ' 145' ' ' LEU . . . -57.34 -47.04 82.61 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.875 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -65.38 -34.52 78.5 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.854 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' SER . . . . . 0.562 ' HG ' ' CG ' ' A' ' 128' ' ' ASP . 36.8 t -75.36 -29.75 59.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.939 0.4 . . . . 0.0 110.65 -177.367 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.795 HD23 ' HG2' ' A' ' 73' ' ' GLN . 3.9 pp . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.339 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.68 ' HE1' ' HG2' ' A' ' 71' ' ' GLU . 97.3 mmm . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 120.949 0.404 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.5 m -81.59 155.1 71.32 Favored Pre-proline 0 C--O 1.223 -0.329 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.656 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.4 Cg_exo -53.97 -51.39 10.81 Favored 'Trans proline' 0 N--CA 1.477 0.52 0 C-N-CA 122.659 2.239 . . . . 0.0 114.609 -173.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -67.2 -35.85 80.48 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.34 0.59 . . . . 0.0 110.358 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.68 ' HG2' ' HE1' ' A' ' 67' ' ' MET . 5.5 tp10 -58.04 -53.3 59.85 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.928 173.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.62 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 24.3 mt -58.07 -23.26 53.93 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 113.808 -1.542 . . . . 0.0 112.933 -175.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 13.7 mt-30 -70.93 -41.74 70.79 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 175.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.56 -25.53 66.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.141 171.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.62 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 11.3 t60 -64.38 -40.68 96.29 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.08 174.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.487 ' OH ' ' HB3' ' A' ' 99' ' ' HIS . 3.6 m-30 -67.93 -30.72 70.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.235 0.54 . . . . 0.0 109.995 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.665 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.4 t80 -69.43 -51.83 32.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.762 177.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.665 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.4 mmmt -79.36 -12.51 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.412 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.4 tpt -44.88 -36.83 3.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.989 0.915 . . . . 0.0 112.688 -172.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.502 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -147.57 10.23 0.95 Allowed 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.867 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.717 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 28.6 t70 -86.38 88.22 7.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.319 0.58 . . . . 0.0 110.396 -178.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.498 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 29.0 m-85 -112.02 -0.92 15.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.944 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -85.12 -13.82 49.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.043 -171.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.69 13.95 81.71 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.167 -0.54 . . . . 0.0 113.363 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -92.97 -5.29 51.02 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.712 0.756 . . . . 0.0 110.781 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 62.47 20.01 11.6 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.596 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.48 HD11 ' HB2' ' A' ' 135' ' ' TYR . 1.3 mm? -132.32 153.18 50.98 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.212 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.522 ' HB2' HG23 ' A' ' 136' ' ' ILE . 3.9 mm? -106.59 114.53 28.69 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.173 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.499 ' OD2' ' HG3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -93.77 -178.91 4.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.3 178.819 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.09 -51.04 48.91 Favored Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 114.309 0.484 . . . . 0.0 114.309 -176.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.598 HD11 ' N ' ' A' ' 92' ' ' GLU . 4.4 pp -73.8 -28.45 61.65 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.115 0.457 . . . . 0.0 110.875 -174.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.717 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 50.4 mt-10 -66.68 -52.15 48.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.037 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 0.838 ' HB3' HG12 ' A' ' 97' ' ' ILE . 30.3 mt -66.71 -7.38 20.53 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.393 -177.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.751 ' HA ' HD12 ' A' ' 121' ' ' ILE . 75.4 m -56.84 -31.77 65.09 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.109 176.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -91.61 -32.17 15.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.074 0.464 . . . . 0.0 111.15 175.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -84.29 -41.7 16.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.226 -169.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.874 ' HB ' HG12 ' A' ' 121' ' ' ILE . 40.2 mm -68.05 -17.85 22.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -177.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.795 HG21 HD11 ' A' ' 117' ' ' LEU . 4.7 m -60.01 -25.91 65.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.166 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.487 ' HB3' ' OH ' ' A' ' 76' ' ' TYR . 62.2 m-70 -103.5 -33.56 9.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.663 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.812 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 32.6 t -58.59 -51.41 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 177.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.6 t60 . . . . . 0 C--O 1.233 0.2 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 167.494 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.584 ' HB2' HG23 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.507 -0.689 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . 0.481 ' HD2' ' O ' ' A' ' 98' ' ' THR . 53.4 Cg_endo -79.65 65.67 8.86 Favored 'Trans proline' 0 N--CA 1.441 -1.56 0 C-N-CA 121.552 1.501 . . . . 0.0 111.323 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -49.84 94.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.505 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -106.94 -47.78 3.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.064 -179.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.4 m 179.99 117.96 0.05 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -177.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.541 ' O ' HG13 ' A' ' 118' ' ' ILE . 16.3 pt-20 -56.76 -36.69 70.1 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.794 -175.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -66.78 -45.63 77.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.833 0.349 . . . . 0.0 110.182 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.09 -44.32 96.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.644 0.735 . . . . 0.0 109.888 177.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.795 HD11 HG21 ' A' ' 98' ' ' THR . 11.7 mt -60.23 -37.7 81.13 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.699 -1.137 . . . . 0.0 111.521 176.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.683 ' HA ' HD11 ' A' ' 121' ' ' ILE . 61.8 mt -61.07 -37.34 77.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.839 0.352 . . . . 0.0 110.91 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -65.38 -38.14 89.14 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.477 0.656 . . . . 0.0 109.266 174.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.2 mp -61.57 -42.16 92.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.765 174.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.874 HG12 ' HB ' ' A' ' 97' ' ' ILE . 93.3 mt -60.52 -36.93 73.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.603 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.823 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 33.9 t70 -61.31 -43.64 98.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.59 -29.04 60.52 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.718 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.689 HG23 HD11 ' A' ' 97' ' ' ILE . 79.1 t -65.01 -53.81 36.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.494 0.187 . . . . 0.0 110.759 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 67.4 mt -65.65 -14.11 60.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.37 -175.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.823 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 15.9 mtp85 -103.66 -36.0 8.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.105 -177.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -124.08 -47.08 1.92 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -170.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.554 ' HB3' HG12 ' A' ' 124' ' ' VAL . 12.6 t70 -71.91 -19.29 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.77 0.795 . . . . 0.0 109.809 -178.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.54 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 1.6 t70 -72.56 90.85 1.37 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.689 166.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -79.19 -27.9 42.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.214 -170.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -88.26 -3.66 58.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.76 -176.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.54 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 14.1 t30 61.65 49.48 4.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.586 0.708 . . . . 0.0 110.727 179.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 52.8 p30 -107.62 -8.29 16.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.516 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.37 1.31 90.41 Favored Glycine 0 C--N 1.329 0.183 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.055 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.48 ' HB2' HD11 ' A' ' 87' ' ' LEU . 50.4 m-85 -131.21 178.02 7.02 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 174.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.543 HG23 HD12 ' A' ' 93' ' ' LEU . 6.1 tt -114.97 126.21 72.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.217 0.532 . . . . 0.0 109.607 175.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -102.78 -178.22 3.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.704 175.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.832 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 44.1 t80 -56.75 -46.91 81.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 123.341 0.4 . . . . 0.0 111.598 -172.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.2 -28.27 67.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.646 0.26 . . . . 0.0 111.344 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.46 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.5 mt-10 -72.74 -56.37 5.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.231 -175.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.832 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.9 p90 -70.6 -27.72 64.3 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.159 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.52 -34.24 77.76 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.337 179.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -76.7 -32.61 57.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.374 177.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' SER . . . . . 0.555 ' OG ' ' HA ' ' A' ' 141' ' ' PHE . 1.3 p -82.27 -30.36 30.68 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.572 -174.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.5 pp . . . . . 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.512 178.56 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.573 ' HB2' HD22 ' A' ' 72' ' ' LEU . 92.3 mmm . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.482 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 6.3 m -76.4 160.7 77.0 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -178.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.482 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 9.9 Cg_endo -52.79 -43.69 53.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.928 2.418 . . . . 0.0 112.693 -178.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.428 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 6.9 pt20 -56.98 -48.37 78.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.531 178.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.445 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 3.8 mm-40 -59.61 -52.97 63.26 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.502 175.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.573 HD22 ' HB2' ' A' ' 67' ' ' MET . 24.3 mt -60.38 -21.68 62.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.184 -166.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLN . . . . . 0.548 ' HG2' HD22 ' A' ' 145' ' ' LEU . 76.8 mt-30 -70.34 -46.2 64.62 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 174.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.9 tp -66.15 -22.36 66.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.831 172.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.553 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.1 t60 -66.98 -42.97 84.19 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.709 ' CD2' HG23 ' A' ' 100' ' ' VAL . 4.3 m-30 -70.32 -31.47 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 178.03 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.612 ' HD1' ' HE1' ' A' ' 141' ' ' PHE . 57.6 t80 -67.59 -53.28 29.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -80.62 -13.85 58.69 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.581 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.452 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.6 tpt -44.23 -40.0 4.84 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.752 0.821 . . . . 0.0 112.401 -170.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.652 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -146.49 10.41 1.09 Allowed 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.944 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.611 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.4 t70 -84.63 85.15 7.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.408 0.623 . . . . 0.0 109.764 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' TYR . . . . . 0.652 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 69.5 m-85 -104.14 -6.66 20.84 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.511 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 p30 -77.76 -13.86 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.203 0.525 . . . . 0.0 110.943 -178.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 67.34 26.86 73.47 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.554 -0.748 . . . . 0.0 113.161 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -99.98 -2.87 33.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 117.464 0.632 . . . . 0.0 110.462 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 63.12 31.89 15.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.349 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.519 HD23 ' HB2' ' A' ' 135' ' ' TYR . 15.8 mt -141.89 141.09 33.02 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.529 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.621 ' HB2' HG23 ' A' ' 136' ' ' ILE . 4.0 mm? -95.36 109.25 21.44 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -83.95 161.88 20.64 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.784 175.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.96 -48.5 24.85 Favored Glycine 0 C--O 1.23 -0.15 0 CA-C-O 119.782 -0.455 . . . . 0.0 113.842 -178.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.694 HD11 ' N ' ' A' ' 92' ' ' GLU . 4.1 pp -68.48 -32.27 72.15 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 117.409 0.604 . . . . 0.0 111.592 -175.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.694 ' N ' HD11 ' A' ' 91' ' ' LEU . 50.4 mt-10 -71.25 -58.78 3.22 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.555 1.169 . . . . 0.0 108.272 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LEU . . . . . 1.106 ' HG ' HG12 ' A' ' 97' ' ' ILE . 12.3 tp -60.84 -11.5 7.96 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 112.897 -1.956 . . . . 0.0 111.466 -174.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.81 ' HA ' HD11 ' A' ' 121' ' ' ILE . 7.9 m -52.72 -32.28 42.13 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.448 0.699 . . . . 0.0 112.71 178.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.0 -35.2 15.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.958 178.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.594 ' O ' HG21 ' A' ' 100' ' ' VAL . . . -75.36 -41.3 56.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.276 -170.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 1.106 HG12 ' HG ' ' A' ' 93' ' ' LEU . 26.8 mm -60.07 -19.89 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -174.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.641 HG21 HD22 ' A' ' 117' ' ' LEU . 4.4 m -55.25 -27.94 49.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.35 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.475 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 58.6 m-70 -107.93 -18.08 13.89 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.929 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.709 HG23 ' CD2' ' A' ' 76' ' ' TYR . 2.3 t -84.99 -53.52 10.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.531 -174.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 21.2 t60 . . . . . 0 C--O 1.235 0.323 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 178.778 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.542 ' HA ' ' O ' ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.511 -0.521 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -80.81 69.64 7.87 Favored 'Trans proline' 0 N--CA 1.441 -1.589 0 C-N-CA 121.795 1.663 . . . . 0.0 111.197 174.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.9 75.34 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.015 0.912 . . . . 0.0 110.734 171.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.401 ' CG ' ' H ' ' A' ' 113' ' ' SER . 12.8 ptt? -95.26 -58.01 2.25 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.04 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.401 ' H ' ' CG ' ' A' ' 112' ' ' MET . 13.7 m -160.99 127.24 3.93 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 176.2 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.59 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.72 -38.38 64.26 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.805 -178.011 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.494 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 20.7 t70 -64.8 -46.22 82.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.27 0.557 . . . . 0.0 110.861 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.57 -38.66 91.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.291 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.641 HD22 HG21 ' A' ' 98' ' ' THR . 6.7 tp -63.85 -32.12 73.53 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.309 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . 0.59 HG13 ' O ' ' A' ' 114' ' ' GLU . 73.9 mt -59.36 -45.48 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.129 174.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -64.29 -38.17 90.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.3 0.572 . . . . 0.0 110.039 175.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . 0.516 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.3 mp -58.51 -46.67 89.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.068 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.81 HD11 ' HA ' ' A' ' 94' ' ' SER . 71.4 mt -62.9 -45.49 98.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 0.0 110.39 177.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . 0.521 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.6 t70 -57.77 -44.94 86.51 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.12 52.52 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.691 177.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' VAL . . . . . 0.791 HG22 HD11 ' A' ' 97' ' ' ILE . 46.2 t -65.3 -54.77 25.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.805 174.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.92 -7.25 26.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.193 0.52 . . . . 0.0 111.441 -176.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 9.9 mtt180 -107.74 -36.04 6.52 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.834 -178.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -127.12 -41.79 1.75 Allowed 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.538 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 1.3 m-20 -71.73 -18.47 62.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.497 0.665 . . . . 0.0 110.22 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . 0.562 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 2.2 t70 -77.81 93.12 4.29 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 165.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -79.09 -21.46 46.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.039 -169.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.63 -4.54 53.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -176.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ASN . . . . . 0.43 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 20.3 m120 61.25 34.78 18.52 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.379 -177.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -93.42 -15.16 25.93 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.767 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.3 -2.89 75.34 Favored Glycine 0 N--CA 1.453 -0.17 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.965 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' TYR . . . . . 0.519 ' HB2' HD23 ' A' ' 87' ' ' LEU . 45.5 m-85 -129.35 164.86 22.67 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 120.971 0.415 . . . . 0.0 110.005 178.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ILE . . . . . 0.621 HG23 ' HB2' ' A' ' 88' ' ' LEU . 6.4 tt -106.34 126.59 62.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.509 175.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.575 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 0.2 OUTLIER -103.23 178.96 4.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.304 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' TYR . . . . . 0.809 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.9 t80 -53.02 -48.02 67.88 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.363 0.414 . . . . 0.0 111.264 -176.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.65 -30.02 69.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.963 0.411 . . . . 0.0 111.491 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' GLU . . . . . 0.575 ' HG3' ' OD1' ' A' ' 137' ' ' ASP . 52.1 mt-10 -73.92 -50.79 18.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.251 -177.149 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' PHE . . . . . 0.809 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -74.7 -25.49 59.18 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.596 178.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.97 -43.03 91.31 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.129 0.49 . . . . 0.0 110.102 175.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' LYS . . . . . 0.441 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 34.5 mtmm -74.72 -28.44 60.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.745 176.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.2 t -78.55 -43.04 27.64 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.065 -171.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.548 HD22 ' HG2' ' A' ' 73' ' ' GLN . 2.8 pp . . . . . 0 N--CA 1.462 0.173 0 CA-C-O 120.943 0.401 . . . . 0.0 111.387 -175.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.6 ' HB2' HD23 ' A' ' 72' ' ' LEU . 98.3 mmm . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.655 0.264 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.63 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 41.0 t -88.01 147.82 41.7 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.175 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.66 -44.11 37.1 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.002 2.468 . . . . 0.0 114.125 -174.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.562 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 7.3 pt20 -56.81 -52.91 63.21 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.676 -177.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.63 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.1 pt-20 -73.1 -26.45 61.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.493 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.6 HD23 ' HB2' ' A' ' 67' ' ' MET . 18.0 mt -65.57 -17.68 64.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.717 0.294 . . . . 0.0 111.294 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.529 HE21 ' HA ' ' A' ' 70' ' ' GLN . 43.1 mt-30 -69.93 -47.28 63.01 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 172.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.2 tp -66.3 -19.64 65.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.582 174.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.53 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 26.6 t60 -68.19 -41.84 80.82 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.718 175.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.683 ' CD2' HG21 ' A' ' 100' ' ' VAL . 4.8 m-30 -66.49 -28.53 68.65 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.928 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 64.8 t80 -73.29 -53.87 9.77 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.649 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.456 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -79.62 -12.99 59.81 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.206 -175.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.407 ' HE2' ' HA ' ' A' ' 79' ' ' MET . 1.1 tpt -44.52 -41.3 6.31 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.839 0.712 . . . . 0.0 111.901 -174.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.657 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -140.81 9.91 2.19 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.863 179.573 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.427 ' HB2' HD23 ' A' ' 88' ' ' LEU . 27.3 t70 -86.26 88.81 7.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 110.268 178.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.489 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 21.7 m-85 -106.14 14.53 27.56 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.37 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -112.94 -15.41 12.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.319 -176.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 60.23 27.24 64.97 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.743 -0.662 . . . . 0.0 114.426 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -89.3 3.33 52.48 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 117.766 0.783 . . . . 0.0 110.765 -178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.928 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 2.6 t30 68.84 20.3 8.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.425 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.513 HD23 ' HB2' ' A' ' 135' ' ' TYR . 40.8 mt -143.27 158.47 43.6 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.574 0.702 . . . . 0.0 111.248 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 77' ' ' PHE . 70.6 mt -125.78 118.12 24.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.391 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.57 169.66 12.57 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.94 -35.69 54.16 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.403 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.5 mt -59.07 -42.8 91.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.262 0.553 . . . . 0.0 110.594 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.657 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 37.3 mt-10 -70.76 -50.59 34.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.035 0.921 . . . . 0.0 109.203 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.841 ' HB3' HG12 ' A' ' 97' ' ' ILE . 29.4 mt -65.77 -12.22 52.17 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.733 -171.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.687 ' HA ' HD11 ' A' ' 121' ' ' ILE . 24.4 p -55.61 -31.95 62.7 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.545 0.212 . . . . 0.0 111.4 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.83 -36.82 14.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.234 0.54 . . . . 0.0 111.145 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.557 ' O ' HG22 ' A' ' 100' ' ' VAL . . . -80.2 -43.91 20.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.744 -168.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.89 HG23 ' HA ' ' A' ' 121' ' ' ILE . 32.6 mm -62.82 -20.52 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.673 -174.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.691 HG21 HD23 ' A' ' 117' ' ' LEU . 17.5 m -56.39 -21.3 24.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.488 174.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -108.67 -44.5 4.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.207 174.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.683 HG21 ' CD2' ' A' ' 76' ' ' TYR . 2.9 t -59.16 -48.79 85.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.67 -173.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.45 ' CD2' HG13 ' A' ' 120' ' ' ILE . 27.8 t60 -80.59 76.53 7.44 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.765 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.543 ' HB2' ' O ' ' A' ' 105' ' ' GLY . 21.1 pttm -58.28 112.42 1.55 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.168 177.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -107.24 -74.52 0.66 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -106.88 46.71 0.91 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.139 0.495 . . . . 0.0 109.869 176.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.543 ' O ' ' HB2' ' A' ' 102' ' ' LYS . . . 179.61 178.27 48.32 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.054 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 17.0 m -106.42 -80.16 0.56 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.893 0.346 . . . . 0.0 110.704 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -96.66 -19.06 19.28 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 121.082 0.467 . . . . 0.0 110.851 176.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -73.31 135.2 44.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.733 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.406 ' HA ' ' HD3' ' A' ' 110' ' ' PRO . . . -70.23 114.35 25.03 Favored Pre-proline 0 CA--C 1.507 -0.695 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.096 177.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 3.4 Cg_exo -79.41 67.73 8.51 Favored 'Trans proline' 0 N--CA 1.439 -1.702 0 C-N-CA 121.496 1.464 . . . . 0.0 111.379 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.71 83.47 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.945 0.879 . . . . 0.0 110.779 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 12.8 ptt? -102.95 -54.24 2.67 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.837 -176.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.7 m -161.38 119.15 2.31 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.616 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.04 -40.67 67.29 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.961 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.456 ' HA ' HD13 ' A' ' 118' ' ' ILE . 33.9 m-20 -71.9 -40.67 68.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.793 0.33 . . . . 0.0 110.926 -178.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -63.89 -37.02 85.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.469 0.652 . . . . 0.0 109.357 173.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.691 HD23 HG21 ' A' ' 98' ' ' THR . 12.5 tp -65.93 -31.97 73.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.066 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.616 HG13 ' O ' ' A' ' 114' ' ' GLU . 88.1 mt -61.18 -45.19 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.895 0.379 . . . . 0.0 110.249 174.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -66.76 -31.79 72.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.844 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.543 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -62.31 -42.57 95.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.202 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.89 ' HA ' HG23 ' A' ' 97' ' ' ILE . 80.3 mt -64.59 -48.27 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.903 176.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.533 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 70.6 m-20 -50.81 -48.17 59.78 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.25 -28.42 34.66 Favored Glycine 0 C--O 1.224 -0.471 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.491 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.782 HG22 HD11 ' A' ' 97' ' ' ILE . 54.9 t -72.08 -55.04 14.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 O-C-N 122.708 -0.289 . . . . 0.0 111.125 174.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.8 mp -65.92 -13.98 60.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.313 0.578 . . . . 0.0 111.044 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.533 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 47.7 mtt180 -110.48 -29.59 8.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.881 -175.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -125.91 -46.44 1.69 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.552 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 19.3 m-20 -68.06 -22.52 64.93 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 121.243 0.544 . . . . 0.0 110.275 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.461 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 0.8 OUTLIER -76.09 99.53 4.67 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.818 168.626 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -80.75 -17.43 51.0 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.657 -171.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.88 -0.08 43.11 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.531 -173.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.6 m120 61.75 37.53 15.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.996 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -99.6 -19.62 16.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.52 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 85.87 6.54 82.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.436 178.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.513 ' HB2' HD23 ' A' ' 87' ' ' LEU . 50.9 m-85 -126.78 160.74 29.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.452 HG23 HD23 ' A' ' 93' ' ' LEU . 7.3 tt -110.86 117.39 54.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.082 0.944 . . . . 0.0 110.568 178.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -90.33 168.64 11.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.258 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.793 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 7.3 t80 -51.83 -47.24 64.43 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.37 -26.49 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.04 0.447 . . . . 0.0 110.984 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.461 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 44.2 mt-10 -76.12 -53.31 8.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.97 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.793 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -72.49 -26.39 61.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.587 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.71 -42.42 97.19 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 174.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.444 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.5 mtmm -71.57 -28.92 64.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.781 176.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.1 t -80.21 -39.09 29.83 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.727 -172.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.63 HD11 HE21 ' A' ' 146' ' ' GLN . 4.3 pp -84.9 -15.12 45.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.991 -178.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.63 HE21 HD11 ' A' ' 145' ' ' LEU . 24.4 mm-40 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.083 173.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.605 ' HB2' HD23 ' A' ' 72' ' ' LEU . 98.1 mmm . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 120.653 0.263 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -91.74 156.58 42.67 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.858 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.42 -50.75 12.82 Favored 'Trans proline' 0 N--CA 1.475 0.436 0 C-N-CA 122.85 2.367 . . . . 0.0 114.146 -173.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -62.45 -42.76 99.7 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.765 -174.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.5 pt-20 -77.6 -27.33 51.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.605 HD23 ' HB2' ' A' ' 67' ' ' MET . 13.5 mt -68.23 -17.96 64.44 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 120.745 0.307 . . . . 0.0 111.479 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.477 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 16.2 mt-30 -70.76 -45.74 64.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 171.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.76 -20.62 66.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.641 173.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.511 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 62.3 t60 -68.7 -33.24 73.61 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.385 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 4.3 m-30 -72.12 -31.51 66.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 175.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.653 ' HB2' ' HZ ' ' A' ' 141' ' ' PHE . 47.6 t80 -69.03 -53.2 21.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.284 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.548 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.56 -10.4 59.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.678 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.489 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 4.8 tpt -44.08 -39.43 4.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.904 0.881 . . . . 0.0 112.749 -171.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.506 ' O ' ' HG3' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -144.74 10.21 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.344 -178.92 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.785 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.5 t70 -74.83 94.84 2.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.617 0.722 . . . . 0.0 110.819 -176.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -122.02 18.83 10.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.652 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -108.08 -13.67 14.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -178.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 70.74 15.25 73.45 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.509 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -95.13 -4.85 45.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.657 0.728 . . . . 0.0 111.012 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.4 ' O ' HD21 ' A' ' 87' ' ' LEU . 47.2 m-80 62.69 19.76 11.6 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.691 177.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.508 HD13 ' HB2' ' A' ' 135' ' ' TYR . 2.4 mm? -129.14 163.31 25.79 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.644 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 86.9 mt -120.09 113.74 20.93 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 121.212 -0.195 . . . . 0.0 110.685 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.492 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 0.0 OUTLIER -86.25 175.66 8.35 Favored 'General case' 0 C--O 1.209 -1.059 0 O-C-N 123.794 0.684 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.44 -53.72 23.41 Favored Glycine 0 CA--C 1.518 0.232 0 N-CA-C 114.548 0.579 . . . . 0.0 114.548 -176.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.625 HD11 ' N ' ' A' ' 92' ' ' GLU . 3.9 pp -80.33 -28.63 38.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.574 0.687 . . . . 0.0 111.573 -172.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.785 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 40.7 tt0 -70.54 -51.45 28.61 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.891 0.853 . . . . 0.0 108.866 173.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 1.007 ' HG ' HG12 ' A' ' 97' ' ' ILE . 17.1 tp -65.95 -12.57 55.81 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.018 -179.165 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.756 ' HA ' HD11 ' A' ' 121' ' ' ILE . 28.0 m -52.96 -31.89 42.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.187 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 m -87.71 -22.26 24.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.07 0.462 . . . . 0.0 111.287 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.566 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -93.08 -39.18 11.22 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -171.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 1.007 HG12 ' HG ' ' A' ' 93' ' ' LEU . 43.6 mm -64.83 -21.55 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-O 120.962 0.41 . . . . 0.0 110.777 -179.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.777 HG21 HD23 ' A' ' 117' ' ' LEU . 3.4 m -57.9 -24.77 59.21 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -111.78 -27.55 8.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.986 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.76 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 40.5 t -61.7 -59.81 3.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 175.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 49.4 t60 -79.01 80.35 5.35 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.312 0.577 . . . . 0.0 110.11 174.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.523 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -79.94 123.16 27.55 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.344 175.284 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -85.49 -56.11 3.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.848 -175.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -123.02 46.55 2.15 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.12 0.486 . . . . 0.0 111.402 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.88 -161.19 26.8 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.464 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 28.6 m -117.98 -47.32 2.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.376 0.608 . . . . 0.0 109.802 175.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.502 ' CD ' ' H ' ' A' ' 107' ' ' GLU . 0.0 OUTLIER -93.05 -39.39 11.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.144 -179.183 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -56.63 116.32 3.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.52 -1.218 . . . . 0.0 113.043 -171.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.694 ' HB1' HG23 ' A' ' 98' ' ' THR . . . -71.19 116.11 43.53 Favored Pre-proline 0 CA--C 1.504 -0.812 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.968 172.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.43 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.2 Cg_endo -79.84 67.1 8.72 Favored 'Trans proline' 0 N--CA 1.438 -1.748 0 C-N-CA 121.343 1.362 . . . . 0.0 111.625 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.21 78.97 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 122.144 0.973 . . . . 0.0 110.37 172.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.414 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.4 ptt? -97.76 -56.39 2.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.063 -1.426 . . . . 0.0 110.671 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.0 m -155.62 119.31 4.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.446 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.8 pt-20 -56.9 -37.5 71.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.868 -170.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.53 -45.23 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.451 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.53 -39.43 94.4 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.265 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.777 HD23 HG21 ' A' ' 98' ' ' THR . 13.2 tp -62.23 -38.36 88.93 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.288 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 114' ' ' GLU . 76.5 mt -63.46 -41.88 94.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 174.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -67.26 -30.6 70.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.307 0.575 . . . . 0.0 110.16 175.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.406 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -63.36 -43.0 98.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.1 173.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.756 HD11 ' HA ' ' A' ' 94' ' ' SER . 82.0 mt -63.79 -47.35 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.646 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.721 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 0.5 OUTLIER -52.52 -47.74 66.47 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.363 176.216 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.19 -34.38 53.22 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.18 -0.533 . . . . 0.0 111.903 177.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.724 HG23 HD11 ' A' ' 97' ' ' ILE . 52.5 t -65.78 -52.07 54.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.621 0.248 . . . . 0.0 110.661 175.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.401 HD12 HD22 ' A' ' 93' ' ' LEU . 8.9 mp -67.74 -1.05 4.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.67 -177.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.721 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.9 mtm180 -118.2 -32.62 4.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.605 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -123.77 -45.51 2.03 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -176.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.502 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 4.4 m-20 -71.97 -17.05 62.09 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.132 0.492 . . . . 0.0 110.4 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.55 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.8 t70 -76.36 93.25 3.44 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 166.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -79.37 -17.59 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.604 -168.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.45 8.07 16.42 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.244 -170.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.403 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 15.1 m120 61.02 36.2 18.62 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.984 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.7 p30 -98.38 -4.12 35.47 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.784 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.2 -16.27 23.86 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.986 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.508 ' HB2' HD13 ' A' ' 87' ' ' LEU . 16.5 m-85 -116.21 173.94 6.32 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.503 HD11 ' HB3' ' A' ' 141' ' ' PHE . 7.1 tt -108.7 121.98 62.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.705 177.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -91.58 170.11 10.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.345 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.76 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 38.1 t80 -52.33 -48.77 65.28 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.113 0.258 . . . . 0.0 110.63 -178.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.6 -28.01 69.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.928 0.394 . . . . 0.0 111.686 -176.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.55 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 47.7 mt-10 -76.98 -49.21 15.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.481 -173.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.76 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -76.29 -27.99 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.534 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.99 88.01 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.853 0.359 . . . . 0.0 110.553 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.411 ' HE3' ' HB2' ' A' ' 143' ' ' LYS . 47.6 mtmt -77.42 -29.01 52.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.527 175.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 21.7 t -75.58 -34.55 60.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.481 -175.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 pp -80.98 9.3 6.72 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.464 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.413 ' C ' ' HZ2' ' A' ' 102' ' ' LYS . 25.8 mm-40 . . . . . 0 C--O 1.246 0.89 0 CA-C-O 118.544 -0.741 . . . . 0.0 110.071 175.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.795 ' HE2' ' HG3' ' A' ' 71' ' ' GLU . 96.9 mmm . . . . . 0 N--CA 1.463 0.194 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.436 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 55.3 m -116.8 162.99 24.38 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.431 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 81.1 Cg_exo -50.35 -49.33 16.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.284 2.656 . . . . 0.0 115.222 -172.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -59.31 -48.68 80.73 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -172.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.795 ' HG3' ' HE2' ' A' ' 67' ' ' MET . 1.7 pm0 -72.98 -28.65 62.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.707 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.617 HD23 ' HB2' ' A' ' 67' ' ' MET . 27.6 mt -68.09 -17.62 64.43 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.166 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 28.7 mt-30 -69.59 -47.46 63.46 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.91 -19.36 65.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.697 173.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.574 ' CE1' ' HE1' ' A' ' 79' ' ' MET . 25.1 t60 -71.57 -42.29 68.0 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.908 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.787 ' CD2' HG21 ' A' ' 100' ' ' VAL . 7.4 m-30 -66.95 -29.09 68.86 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.511 ' HA ' HD12 ' A' ' 88' ' ' LEU . 58.0 t80 -73.01 -50.39 23.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.864 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.429 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.3 mmmt -80.94 -26.62 36.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -175.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.574 ' HE1' ' CE1' ' A' ' 75' ' ' HIS . 22.3 tpp -44.72 -53.94 6.79 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -170.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.709 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -122.54 9.18 9.6 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.438 -174.532 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.661 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.0 t70 -83.89 72.8 10.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 109.554 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.427 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.8 OUTLIER -98.17 -7.02 30.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.915 -178.461 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -77.22 -13.65 59.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.8 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.3 24.06 74.19 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.414 -0.812 . . . . 0.0 113.381 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.465 ' ND2' ' HB2' ' A' ' 87' ' ' LEU . 14.1 p-10 -104.57 -9.71 18.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 117.64 0.72 . . . . 0.0 111.719 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.8 m120 67.71 30.21 6.54 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.538 HD21 ' HB2' ' A' ' 135' ' ' TYR . 13.6 mt -138.47 163.95 30.63 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.298 -0.865 . . . . 0.0 108.939 172.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' A' ' 77' ' ' PHE . 84.2 mt -125.86 117.51 23.52 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 123.23 0.331 . . . . 0.0 110.974 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.59 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.7 p30 -98.87 -170.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.317 177.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.12 -50.22 56.36 Favored Glycine 0 C--N 1.329 0.177 0 N-CA-C 114.32 0.488 . . . . 0.0 114.32 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.701 HD11 ' N ' ' A' ' 92' ' ' GLU . 3.7 pp -75.0 -29.48 60.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.52 0.66 . . . . 0.0 110.749 -173.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.709 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 47.9 mt-10 -68.8 -50.04 53.55 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.84 ' HB3' HG12 ' A' ' 97' ' ' ILE . 40.8 mt -66.82 -13.17 61.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.959 -178.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.636 ' HA ' HD11 ' A' ' 121' ' ' ILE . 48.4 m -57.39 -32.24 66.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.646 0.26 . . . . 0.0 111.321 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 m -92.39 -33.45 14.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 110.883 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.668 ' O ' HG22 ' A' ' 100' ' ' VAL . . . -80.98 -51.08 8.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.091 -169.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.84 HG12 ' HB3' ' A' ' 93' ' ' LEU . 24.3 mm -57.66 -24.68 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.908 -174.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.631 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 4.2 m -58.4 -22.14 52.91 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.188 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.502 ' CE1' ' HB3' ' A' ' 109' ' ' ALA . 43.8 m-70 -106.67 -19.84 13.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.826 174.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.787 HG21 ' CD2' ' A' ' 76' ' ' TYR . 12.4 t -86.01 -60.14 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -170.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.412 ' CD2' HG13 ' A' ' 120' ' ' ILE . 74.1 t60 -51.2 125.79 14.95 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.373 0.42 . . . . 0.0 111.766 -170.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 144' ' ' SER . 23.7 ttmm -69.13 77.02 0.35 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.507 -173.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -113.46 -63.61 1.42 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 165.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.769 ' HB2' ' HB3' ' A' ' 110' ' ' PRO . 36.4 mt-10 -132.08 28.76 4.43 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 167.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -102.35 122.39 7.51 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 114.74 -1.118 . . . . 0.0 113.211 -169.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 48.4 m -153.31 -67.9 0.15 Allowed 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -107.25 -52.08 2.82 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.682 167.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -71.62 155.94 39.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.562 -1.199 . . . . 0.0 112.113 -178.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.502 ' HB3' ' CE1' ' A' ' 99' ' ' HIS . . . -100.17 122.04 51.66 Favored Pre-proline 0 N--CA 1.447 -0.584 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.462 174.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.769 ' HB3' ' HB2' ' A' ' 104' ' ' GLU . 45.4 Cg_endo -71.02 63.94 2.53 Favored 'Trans proline' 0 N--CA 1.455 -0.735 0 C-N-CA 122.11 1.873 . . . . 0.0 111.769 170.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.94 79.03 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.742 0.782 . . . . 0.0 111.299 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 18.3 ptt? -90.55 -59.16 2.25 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.67 177.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 75.4 m -167.36 129.93 1.68 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.601 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.4 OUTLIER -62.18 -28.26 69.54 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 123.264 0.352 . . . . 0.0 111.861 -175.028 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.71 -42.42 70.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -64.14 -40.71 96.74 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.494 HD13 ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER -62.76 -36.26 82.49 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.919 -1.492 . . . . 0.0 110.563 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.601 HG13 ' O ' ' A' ' 114' ' ' GLU . 68.6 mt -60.37 -43.48 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.904 0.383 . . . . 0.0 110.374 175.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.61 -38.32 87.19 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.606 0.717 . . . . 0.0 109.648 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.419 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -64.22 -39.99 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.3 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.777 ' HA ' HG23 ' A' ' 97' ' ' ILE . 79.2 mt -65.71 -41.82 91.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.466 178.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.764 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.1 t70 -62.94 -43.3 99.18 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.15 -30.39 57.66 Favored Glycine 0 C--O 1.224 -0.498 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.276 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.729 HG22 HD11 ' A' ' 97' ' ' ILE . 45.6 t -65.43 -49.28 79.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.747 0.308 . . . . 0.0 110.932 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.4 HD21 ' O ' ' A' ' 134' ' ' GLY . 96.2 mt -67.82 -9.89 48.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.995 0.426 . . . . 0.0 111.195 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.764 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.4 mtp85 -107.93 -34.78 6.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.308 -178.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -121.62 -47.31 2.22 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -171.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.505 ' HB2' HG12 ' A' ' 124' ' ' VAL . 15.1 m-20 -71.94 -21.11 61.65 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.058 0.456 . . . . 0.0 110.788 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.508 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.2 t70 -76.66 91.44 3.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 168.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -78.43 -18.25 55.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.627 -167.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -117.25 16.02 14.87 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.789 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 56.84 44.16 23.74 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.563 170.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.08 -15.46 15.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.692 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.4 ' O ' HD21 ' A' ' 125' ' ' LEU . . . 87.82 1.97 82.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.203 176.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.538 ' HB2' HD21 ' A' ' 87' ' ' LEU . 45.9 m-85 -132.74 170.88 14.62 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.56 HG23 HD22 ' A' ' 93' ' ' LEU . 7.1 tt -111.35 122.49 65.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.331 0.586 . . . . 0.0 109.739 174.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -103.3 -177.04 3.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.099 176.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.847 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.3 t80 -55.04 -48.99 72.7 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.551 0.532 . . . . 0.0 111.694 -171.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -23.18 64.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.004 0.43 . . . . 0.0 111.464 -175.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.508 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 51.7 mt-10 -80.69 -53.11 6.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -174.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.847 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.8 p90 -68.88 -32.11 71.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.047 177.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.77 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.998 0.428 . . . . 0.0 110.671 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -72.72 -29.34 63.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.38 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.441 ' O ' ' HB2' ' A' ' 102' ' ' LYS . 9.0 t -79.84 -25.47 40.77 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -174.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.812 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 76.5 mt -79.96 -57.53 3.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.311 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 . . . . . 0 C--O 1.245 0.85 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.118 -177.751 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.665 ' HB2' HD22 ' A' ' 72' ' ' LEU . 93.5 mmm . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.828 0.347 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.545 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 5.8 m -85.53 153.83 58.84 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.874 177.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.593 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 18.9 Cg_endo -59.77 -26.96 83.8 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.463 2.775 . . . . 0.0 114.698 -169.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.401 ' HG3' ' H ' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -68.68 -54.92 13.35 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 121.421 0.629 . . . . 0.0 109.939 -177.155 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.7 pm0 -67.85 -27.04 66.35 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.249 174.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.74 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 15.1 mt -65.88 -20.62 66.29 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.403 177.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.764 ' HG2' HD11 ' A' ' 145' ' ' LEU . 20.8 mt-30 -72.22 -40.83 67.5 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.01 -24.38 65.11 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.74 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 18.0 t60 -68.92 -39.17 79.78 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.096 176.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.761 ' CD2' HG23 ' A' ' 100' ' ' VAL . 3.9 m-30 -66.94 -34.95 78.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.279 0.561 . . . . 0.0 109.813 175.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.534 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 59.1 t80 -68.48 -53.35 23.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.24 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 28.0 mmmt -80.28 -12.33 59.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.61 -175.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.4 tpt -44.62 -38.89 4.59 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.928 0.768 . . . . 0.0 112.435 -172.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.796 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 1.0 OUTLIER -146.5 11.49 1.14 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.293 -179.645 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.733 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 25.0 t70 -82.56 90.9 6.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.614 0.721 . . . . 0.0 110.326 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -105.01 -10.84 16.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.4 p30 -83.89 -13.7 52.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.606 -173.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 64.09 24.43 68.7 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.358 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -95.07 5.12 52.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.343 0.572 . . . . 0.0 111.018 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.534 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 19.6 m120 59.19 32.34 21.96 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.129 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 27.5 mt -151.31 160.14 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.63 178.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.535 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 60.7 mt -121.32 123.54 42.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.503 176.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.574 ' OD2' ' HG ' ' A' ' 91' ' ' LEU . 0.1 OUTLIER -92.37 177.81 6.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.583 176.71 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.27 -34.71 54.09 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.206 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.574 ' HG ' ' OD2' ' A' ' 89' ' ' ASP . 27.7 mt -71.08 -47.05 60.49 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.176 0.512 . . . . 0.0 110.099 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.796 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 50.6 mt-10 -62.45 -41.59 98.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.547 0.689 . . . . 0.0 109.586 174.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.665 ' HB3' HG12 ' A' ' 97' ' ' ILE . 34.1 mt -68.44 -15.03 63.4 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.744 -175.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.726 ' HA ' HD11 ' A' ' 121' ' ' ILE . 26.6 t -59.9 -32.48 70.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.074 0.464 . . . . 0.0 110.445 178.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 -30.26 17.78 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.393 0.616 . . . . 0.0 110.382 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.569 ' O ' HG21 ' A' ' 100' ' ' VAL . . . -86.22 -55.49 3.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.969 -171.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.917 HG23 ' HA ' ' A' ' 121' ' ' ILE . 33.6 mm -59.03 -25.22 29.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 122.731 0.412 . . . . 0.0 111.793 -174.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.668 HG21 HD23 ' A' ' 117' ' ' LEU . 23.4 m -59.38 -16.06 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.219 0.533 . . . . 0.0 110.867 175.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 43.4 m-70 -110.77 -23.31 11.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.499 174.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.761 HG23 ' CD2' ' A' ' 76' ' ' TYR . 2.1 t -85.19 -45.9 17.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.731 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.44 ' CD2' HG13 ' A' ' 120' ' ' ILE . 35.6 t60 -79.77 117.85 21.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.838 -176.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.485 ' HG2' ' HA ' ' A' ' 106' ' ' SER . 94.2 mttt -72.37 152.95 41.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.511 178.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.465 ' HG2' ' HE3' ' A' ' 112' ' ' MET . 8.2 tp10 -162.64 -87.18 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -91.47 -35.0 14.58 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 171.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -107.44 -177.19 22.57 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.485 ' HA ' ' HG2' ' A' ' 102' ' ' LYS . 39.2 m -136.4 -37.27 0.7 Allowed 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 117.217 0.508 . . . . 0.0 111.023 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.558 ' HG2' ' N ' ' A' ' 108' ' ' GLN . 0.4 OUTLIER -105.35 -46.41 4.22 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.092 175.223 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.558 ' N ' ' HG2' ' A' ' 107' ' ' GLU . 21.2 mt-30 -81.42 157.0 25.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.018 0.437 . . . . 0.0 111.403 -177.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.577 ' HA ' ' O ' ' A' ' 98' ' ' THR . . . -71.81 113.48 20.4 Favored Pre-proline 0 CA--C 1.506 -0.738 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.311 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -85.06 69.36 5.69 Favored 'Trans proline' 0 N--CA 1.434 -1.98 0 C-N-CA 121.738 1.626 . . . . 0.0 110.711 176.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.8 mt -61.07 78.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.958 0.885 . . . . 0.0 111.04 174.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.465 ' HE3' ' HG2' ' A' ' 103' ' ' GLU . 11.6 ptt? -92.74 -56.97 2.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.474 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.9 m -158.61 125.76 4.89 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.423 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.52 -37.86 68.46 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.036 -176.546 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -60.24 -49.24 78.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.435 0.636 . . . . 0.0 110.11 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.13 -41.21 90.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.922 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.668 HD23 HG21 ' A' ' 98' ' ' THR . 8.1 tp -60.79 -39.69 89.82 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.561 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 114' ' ' GLU . 43.5 mt -59.01 -44.27 90.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.636 176.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -69.77 -31.61 69.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.645 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.44 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.2 mp -60.85 -46.5 96.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.125 174.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.917 ' HA ' HG23 ' A' ' 97' ' ' ILE . 83.9 mt -63.03 -47.26 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.251 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.805 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.8 t70 -60.5 -42.27 96.01 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.729 -179.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.49 -32.79 46.27 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.401 176.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.794 HG22 HD11 ' A' ' 97' ' ' ILE . 30.4 t -61.6 -51.1 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.7 0.286 . . . . 0.0 110.426 173.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 7.8 mp -66.54 -10.81 48.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.129 0.49 . . . . 0.0 110.993 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.805 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 25.8 mtp180 -99.67 -32.96 10.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.568 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -136.5 -43.28 0.61 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -171.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.642 ' HB3' HG11 ' A' ' 124' ' ' VAL . 32.0 t0 -72.95 -22.15 60.76 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.383 0.611 . . . . 0.0 110.554 -176.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.26 101.18 6.13 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 168.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -78.42 -29.96 47.39 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.25 -168.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.02 -4.12 59.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.944 -174.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 59.11 36.43 24.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.741 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -96.81 -20.78 17.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.117 -176.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 106.24 -20.46 35.27 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.857 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -114.71 161.58 17.95 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.071 0.462 . . . . 0.0 110.554 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.648 HG23 HD23 ' A' ' 93' ' ' LEU . 6.5 tt -107.04 125.88 63.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.411 175.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -104.13 -176.86 3.2 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.813 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 10.8 t80 -54.49 -43.66 71.97 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.441 0.463 . . . . 0.0 111.494 -174.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.82 -37.05 81.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.577 0.227 . . . . 0.0 111.227 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.479 ' OE1' ' HA ' ' A' ' 136' ' ' ILE . 50.7 mt-10 -71.45 -53.4 14.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.986 -171.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.813 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -70.04 -23.17 63.06 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.825 -178.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.522 ' HA ' HD13 ' A' ' 145' ' ' LEU . . . -79.65 -32.89 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.204 0.526 . . . . 0.0 110.496 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -69.55 -33.01 72.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.022 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.478 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 1.4 p -81.95 -30.57 31.66 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.764 HD11 ' HG2' ' A' ' 73' ' ' GLN . 6.7 mt -53.37 -45.62 69.3 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.149 170.673 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.929 -178.244 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.64 ' HB2' HD22 ' A' ' 72' ' ' LEU . 97.2 mmm . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.459 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 20.3 m -93.54 158.23 37.14 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.912 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.538 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.4 Cg_exo -51.5 -45.68 36.18 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.129 2.552 . . . . 0.0 114.312 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.414 ' H ' ' HG3' ' A' ' 70' ' ' GLN . 1.1 mt-30 -57.24 -54.73 43.52 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.023 -173.102 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.608 ' HG3' ' HE2' ' A' ' 67' ' ' MET . 3.6 pm0 -71.16 -33.3 69.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.88 177.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.647 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 13.9 mt -62.72 -21.06 65.51 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.319 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.792 ' HG2' HD23 ' A' ' 145' ' ' LEU . 16.5 mt-30 -67.17 -48.03 69.21 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 173.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.2 tp -64.04 -22.34 66.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.526 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.647 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 36.0 t60 -72.01 -43.24 65.36 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.131 178.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.571 ' CE2' HD21 ' A' ' 145' ' ' LEU . 5.3 m-30 -62.82 -32.97 74.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 176.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.597 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 32.5 t80 -70.96 -52.65 18.56 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.206 -1.361 . . . . 0.0 110.46 -178.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.406 ' HE3' ' HA ' ' A' ' 78' ' ' LYS . 22.6 mmmt -79.89 -21.31 44.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.717 -175.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.523 ' HE1' ' CE1' ' A' ' 75' ' ' HIS . 19.1 tpp -44.95 -52.99 8.17 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 123.796 0.685 . . . . 0.0 112.2 -173.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.661 ' HA ' ' CE2' ' A' ' 82' ' ' TYR . 1.8 m170 -122.94 9.88 9.44 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.008 -175.706 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.568 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.0 t70 -82.69 56.01 3.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.78 0.8 . . . . 0.0 109.917 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.661 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 47.5 m-85 -71.95 -23.97 61.53 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.713 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.8 p30 -71.83 -14.88 62.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.685 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.74 28.27 65.33 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.132 -0.94 . . . . 0.0 113.491 177.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -96.07 3.81 53.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.498 0.649 . . . . 0.0 111.775 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.481 ' HA ' ' CZ ' ' A' ' 77' ' ' PHE . 12.5 m120 65.61 25.18 11.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.216 0.532 . . . . 0.0 111.492 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.464 HD23 ' HB2' ' A' ' 135' ' ' TYR . 13.4 mt -147.19 156.5 43.02 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.682 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 77' ' ' PHE . 75.8 mt -123.74 121.16 34.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.9 0.381 . . . . 0.0 111.536 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.464 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 13.4 t70 -83.21 168.29 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.394 173.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.51 55.21 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.609 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.464 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.4 mt -61.55 -43.31 99.09 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.491 0.662 . . . . 0.0 110.442 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.568 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.0 mt-10 -67.43 -46.53 72.88 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.959 0.885 . . . . 0.0 109.111 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.762 ' HB3' HG12 ' A' ' 97' ' ' ILE . 24.5 mt -66.61 -9.95 40.77 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.379 -173.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.684 ' HA ' HD12 ' A' ' 121' ' ' ILE . 36.2 t -54.4 -34.73 61.88 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.642 0.258 . . . . 0.0 111.301 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m -91.19 -30.99 16.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.395 -0.522 . . . . 0.0 111.244 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.59 -46.07 14.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.828 -171.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.84 HG23 ' HA ' ' A' ' 121' ' ' ILE . 43.6 mm -65.16 -22.18 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.364 -175.453 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.671 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 11.2 m -62.73 -15.27 52.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.435 ' CE1' ' HB3' ' A' ' 109' ' ' ALA . 61.9 m-70 -114.91 -25.76 8.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 174.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.695 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 58.7 t -66.3 -60.77 2.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.525 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -71.22 119.12 14.9 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.908 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.503 ' HZ2' ' C ' ' A' ' 146' ' ' GLN . 56.0 mttp -75.44 122.22 23.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.495 176.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.446 ' HG2' ' HE2' ' A' ' 112' ' ' MET . 9.3 tp10 -140.2 -75.36 0.34 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.903 0.383 . . . . 0.0 109.991 178.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.81 17.11 20.11 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 122.029 0.918 . . . . 0.0 108.776 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.37 -169.42 40.55 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.949 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.2 m -155.51 -77.57 0.09 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -62.75 -47.79 81.99 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 175.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -82.99 144.91 29.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.513 -1.221 . . . . 0.0 108.773 173.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.63 ' HB2' HG23 ' A' ' 98' ' ' THR . . . -81.99 119.51 75.31 Favored Pre-proline 0 CA--C 1.502 -0.882 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.41 -176.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.671 ' HD2' ' O ' ' A' ' 98' ' ' THR . 57.3 Cg_endo -74.99 71.73 4.89 Favored 'Trans proline' 0 N--CA 1.443 -1.466 0 C-N-CA 121.273 1.315 . . . . 0.0 111.82 174.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.45 ' CD2' ' HB1' ' A' ' 109' ' ' ALA . 3.1 mm? -62.67 76.15 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.669 0.747 . . . . 0.0 110.623 170.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.446 ' HE2' ' HG2' ' A' ' 103' ' ' GLU . 22.5 ptt? -89.55 -59.23 2.27 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.398 -177.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.7 m -163.04 117.49 1.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.487 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.47 -35.29 65.36 Favored 'General case' 0 C--O 1.219 -0.504 0 O-C-N 123.739 0.649 . . . . 0.0 112.03 -174.27 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -65.15 -47.05 78.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.114 0.483 . . . . 0.0 110.53 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.9 -38.62 79.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.682 176.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.423 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.1 tm? -58.0 -39.62 78.71 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.947 177.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 114' ' ' GLU . 39.9 mt -60.6 -46.02 96.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.067 175.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -64.7 -33.49 76.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.298 0.571 . . . . 0.0 110.209 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.3 mp -61.62 -47.92 91.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.437 175.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.84 ' HA ' HG23 ' A' ' 97' ' ' ILE . 70.4 mt -61.92 -43.96 98.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.64 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.642 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.6 t70 -63.08 -39.58 95.12 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.821 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.67 -28.84 60.51 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.911 177.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.714 HG22 HD11 ' A' ' 97' ' ' ILE . 45.5 t -61.8 -51.04 77.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.839 0.352 . . . . 0.0 110.918 174.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.38 -13.07 61.68 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.168 0.509 . . . . 0.0 110.9 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.642 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.6 mtm-85 -94.71 -50.06 5.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.626 -177.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -125.58 -31.61 2.96 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -173.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.54 ' CB ' ' HA ' ' A' ' 124' ' ' VAL . 9.6 t0 -75.14 -23.43 57.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.177 0.513 . . . . 0.0 110.637 -174.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.07 103.97 4.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 167.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -81.79 -18.66 43.33 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.417 -174.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . 0.481 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.1 m120 -83.3 -14.23 53.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.234 -172.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 131' ' ' ASN . 26.8 m-80 67.59 34.42 4.57 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.811 0.694 . . . . 0.0 110.365 -173.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.481 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -102.01 -21.36 14.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.8 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.27 4.61 77.29 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.466 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.464 ' HB2' HD23 ' A' ' 87' ' ' LEU . 59.6 m-85 -127.65 167.84 15.86 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.716 HG23 HD23 ' A' ' 93' ' ' LEU . 4.6 tt -107.86 122.69 62.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.93 0.872 . . . . 0.0 110.498 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -95.48 166.46 11.85 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.364 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.805 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 14.9 t80 -48.37 -47.68 37.21 Favored 'General case' 0 CA--C 1.523 -0.07 0 O-C-N 123.065 0.228 . . . . 0.0 110.869 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.386 -178.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.02 -50.27 64.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.89 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.805 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.2 p90 -74.03 -34.27 64.05 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.71 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.57 84.55 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.993 0.425 . . . . 0.0 110.239 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -72.2 -31.61 66.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.094 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 41.6 t -84.59 -37.04 21.63 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.367 -173.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.792 HD23 ' HG2' ' A' ' 73' ' ' GLN . 3.5 pp -80.54 -21.96 41.3 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.943 0.401 . . . . 0.0 110.963 -176.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.569 HE21 HD11 ' A' ' 145' ' ' LEU . 21.8 mm-40 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.393 -0.813 . . . . 0.0 110.363 178.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.799 ' HE1' ' HG3' ' A' ' 71' ' ' GLU . 97.6 mmm . . . . . 0 N--CA 1.463 0.2 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.783 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 2.9 p -95.46 170.04 8.37 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.664 -0.207 . . . . 0.0 110.939 179.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.783 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 33.6 Cg_endo -61.9 -37.77 63.55 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.356 2.037 . . . . 0.0 114.252 -164.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -54.55 45.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.153 -174.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.799 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 1.5 pm0 -76.46 -28.83 56.69 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.003 178.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.499 ' CD2' ' HB2' ' A' ' 67' ' ' MET . 12.1 mt -63.21 -19.81 64.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.653 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -71.75 -45.42 61.75 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.37 -23.93 67.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.71 172.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.48 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 27.3 t60 -66.94 -39.78 87.39 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.787 176.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.833 ' HE1' HD22 ' A' ' 145' ' ' LEU . 5.2 m-30 -69.21 -25.65 64.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.264 0.554 . . . . 0.0 110.024 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.646 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 44.3 t80 -75.39 -54.23 7.4 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.819 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.646 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.9 mmmt -81.03 -17.38 50.43 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.468 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -45.74 -25.75 0.54 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.103 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.798 ' HE1' HD22 ' A' ' 93' ' ' LEU . 0.2 OUTLIER -157.93 9.56 0.17 Allowed 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.003 -165.385 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.55 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 27.8 t70 -89.12 61.78 5.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.736 0.779 . . . . 0.0 109.627 -176.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.418 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 11.6 m-85 -76.44 -24.13 53.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.932 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -70.34 -14.49 62.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.998 -174.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 63.13 28.14 71.67 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.85 -0.614 . . . . 0.0 113.218 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -96.76 -2.78 43.62 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 117.465 0.633 . . . . 0.0 110.396 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 59.11 34.98 23.63 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.493 HD21 ' HB2' ' A' ' 135' ' ' TYR . 7.6 mt -150.9 155.87 40.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.403 177.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.501 HD12 ' O ' ' A' ' 77' ' ' PHE . 2.3 mm? -114.48 112.04 22.35 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.561 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 12.7 t70 -82.9 161.98 21.7 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 173.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.497 ' HA3' ' HB2' ' A' ' 93' ' ' LEU . . . -54.93 -32.73 56.2 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.103 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.561 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 32.1 mt -59.73 -49.02 79.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.972 0.415 . . . . 0.0 110.31 178.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.55 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.6 mt-10 -63.28 -50.2 71.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.692 0.758 . . . . 0.0 109.15 173.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.798 HD22 ' HE1' ' A' ' 80' ' ' HIS . 46.2 mt -58.96 -15.11 11.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.548 -1.205 . . . . 0.0 113.432 -171.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.9 ' HA ' HD12 ' A' ' 121' ' ' ILE . 65.4 p -52.21 -33.68 42.19 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.294 0.371 . . . . 0.0 111.865 -178.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.39 -31.34 16.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.581 ' O ' HG21 ' A' ' 100' ' ' VAL . . . -94.93 -33.51 12.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -170.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.722 HD11 HG23 ' A' ' 124' ' ' VAL . 31.1 mm -63.67 -18.08 21.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.28 0.562 . . . . 0.0 110.283 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.68 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 2.6 m -60.01 -14.85 18.21 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.683 172.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.452 ' HB3' ' HH ' ' A' ' 76' ' ' TYR . 80.3 m-70 -115.81 -39.99 3.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 174.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.697 HG23 ' CD1' ' A' ' 76' ' ' TYR . 2.6 t -60.54 -53.59 46.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.984 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -76.3 71.1 2.98 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 172.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.627 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 1.6 pptp? -57.58 128.94 39.6 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.834 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -123.22 -63.45 1.25 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.874 -178.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.664 ' HG2' ' HB3' ' A' ' 110' ' ' PRO . 9.3 pt-20 -89.73 -31.77 17.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.769 0.318 . . . . 0.0 110.85 176.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.434 ' HA2' ' HG2' ' A' ' 108' ' ' GLN . . . -157.62 172.33 34.91 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.021 -0.609 . . . . 0.0 111.579 178.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 5.5 m -87.5 -55.22 3.89 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.619 0.21 . . . . 0.0 111.153 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -68.47 -56.51 8.16 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.271 0.558 . . . . 0.0 109.53 176.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.434 ' HG2' ' HA2' ' A' ' 105' ' ' GLY . 19.2 pt20 -60.72 154.27 22.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.682 -1.144 . . . . 0.0 111.799 -172.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.554 ' HB1' HG23 ' A' ' 98' ' ' THR . . . -100.06 115.96 65.03 Favored Pre-proline 0 N--CA 1.443 -0.777 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.395 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.68 ' HD2' ' O ' ' A' ' 98' ' ' THR . 39.2 Cg_endo -69.86 60.58 1.74 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.373 2.048 . . . . 0.0 111.665 172.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.49 77.53 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 121.931 0.872 . . . . 0.0 109.528 175.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.42 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.5 ptt? -83.52 -53.71 5.49 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.982 -1.463 . . . . 0.0 109.891 178.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 58.3 m -164.42 131.97 3.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 175.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.543 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.5 OUTLIER -61.85 -33.65 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.54 -173.695 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -70.51 -40.41 73.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 110.388 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -67.76 -37.72 82.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.621 HD23 HG21 ' A' ' 98' ' ' THR . 9.4 tp -62.02 -42.06 98.76 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.149 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.543 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.7 mt -56.71 -41.64 75.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.932 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -72.49 -33.82 67.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.722 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.02 -36.34 76.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 177.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.9 HD12 ' HA ' ' A' ' 94' ' ' SER . 86.5 mt -65.26 -44.4 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.016 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.752 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 35.0 t70 -63.2 -36.82 84.89 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.02 -32.0 59.2 Favored Glycine 0 C--N 1.332 0.334 0 N-CA-C 111.655 -0.578 . . . . 0.0 111.655 174.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.722 HG23 HD11 ' A' ' 97' ' ' ILE . 49.5 t -64.76 -49.16 81.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.883 0.373 . . . . 0.0 110.154 173.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.52 -10.62 36.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.295 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.752 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 29.2 mtm180 -99.09 -48.3 4.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.482 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -118.91 -37.25 3.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.519 ' HB2' HG12 ' A' ' 124' ' ' VAL . 17.5 m-20 -75.15 -19.64 59.77 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.02 0.438 . . . . 0.0 110.869 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.428 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 0.7 OUTLIER -79.45 94.23 5.52 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 167.281 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -79.47 -20.47 47.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.368 -172.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -82.68 -15.37 52.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.428 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 13.8 m120 62.64 37.96 12.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.277 -171.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -103.98 -5.6 22.05 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.36 -18.84 50.49 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.109 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.493 ' HB2' HD21 ' A' ' 87' ' ' LEU . 29.3 m-85 -115.74 166.31 12.09 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 116.983 0.392 . . . . 0.0 110.367 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.545 HD11 ' CG1' ' A' ' 124' ' ' VAL . 8.5 tt -103.4 121.93 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 CA-C-O 121.855 0.836 . . . . 0.0 109.727 176.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.79 172.13 7.25 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.492 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.863 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 19.1 t80 -51.08 -47.37 61.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.28 0.363 . . . . 0.0 110.969 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.5 71.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.373 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -81.34 -50.82 9.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.819 -171.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.863 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -70.22 -34.55 73.03 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.832 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.482 ' HA ' HD13 ' A' ' 145' ' ' LEU . . . -68.07 -31.56 71.28 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.006 0.432 . . . . 0.0 110.465 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -76.68 -27.9 55.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.04 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.0 t -78.5 -18.69 54.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.833 HD22 ' HE1' ' A' ' 76' ' ' TYR . 76.8 mt -86.82 -45.37 10.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.562 176.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.303 -178.261 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.62 ' HB2' HD23 ' A' ' 72' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.369 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.539 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 50.6 m -84.05 157.46 62.89 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.959 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.38 -45.66 36.07 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.101 2.534 . . . . 0.0 114.283 -172.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -64.15 -43.59 94.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.821 -171.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.539 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 2.5 pm0 -77.06 -26.46 53.56 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.372 174.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.62 HD23 ' HB2' ' A' ' 67' ' ' MET . 13.2 mt -63.21 -21.53 66.28 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.529 ' HG2' HD23 ' A' ' 145' ' ' LEU . 24.6 mt-30 -68.89 -44.99 72.09 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.49 -19.05 65.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.583 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.546 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 45.0 t60 -69.55 -34.15 73.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.373 -0.376 . . . . 0.0 109.992 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.695 ' CD2' HG23 ' A' ' 100' ' ' VAL . 5.1 m-30 -72.06 -27.83 62.94 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.56 ' O ' HD13 ' A' ' 88' ' ' LEU . 34.6 t80 -73.69 -52.66 12.52 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.738 176.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.527 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.28 -13.03 59.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -175.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.447 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 2.2 tpt -45.57 -38.26 6.29 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.173 0.589 . . . . 0.0 112.285 -173.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -143.04 11.14 1.77 Allowed 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.041 -178.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.736 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 35.1 t70 -79.74 84.33 5.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.648 0.737 . . . . 0.0 110.557 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -119.02 22.59 11.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.183 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.7 p30 -110.86 -14.11 14.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.769 -174.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 68.79 25.9 74.9 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.079 -0.51 . . . . 0.0 113.107 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -101.03 -1.95 32.92 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 117.46 0.63 . . . . 0.0 111.371 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 63.21 27.33 15.53 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.172 176.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.58 HD21 ' HB2' ' A' ' 135' ' ' TYR . 15.5 mt -153.27 167.61 28.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.461 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.56 HD13 ' O ' ' A' ' 77' ' ' PHE . 3.0 mm? -124.39 121.81 35.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.356 -179.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.565 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.2 p-10 -104.52 -179.25 3.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.83 -36.79 33.91 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 114.201 0.44 . . . . 0.0 114.201 -177.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.565 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 30.8 mt -64.3 -53.44 48.8 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.321 0.582 . . . . 0.0 110.552 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.736 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 41.6 mt-10 -62.95 -47.98 80.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.916 178.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.801 ' HB3' HG12 ' A' ' 97' ' ' ILE . 37.9 mt -66.23 -10.68 44.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.98 -174.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.937 ' HA ' HD11 ' A' ' 121' ' ' ILE . 24.0 t -56.4 -34.52 66.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.734 0.302 . . . . 0.0 110.845 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.9 m -92.22 -28.57 16.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.239 0.542 . . . . 0.0 111.569 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.527 ' O ' HG21 ' A' ' 100' ' ' VAL . . . -83.72 -47.13 11.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.739 -171.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.801 HG12 ' HB3' ' A' ' 93' ' ' LEU . 33.8 mm -60.14 -20.84 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.383 -175.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.811 HG23 ' HB1' ' A' ' 109' ' ' ALA . 8.9 m -51.02 -30.55 15.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.971 174.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.456 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 68.5 m-70 -103.82 -33.07 9.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.687 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.695 HG23 ' CD2' ' A' ' 76' ' ' TYR . 2.5 t -68.06 -51.74 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.478 -173.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -74.67 89.11 2.23 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.7 pptp? -103.25 154.98 18.78 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -165.58 -46.91 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.167 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.5 mm-40 -95.49 42.28 1.09 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.861 173.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.36 -144.7 6.25 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -177.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 2.9 t -146.19 -78.84 0.17 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -115.07 0.5 13.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.293 1.044 . . . . 0.0 109.701 174.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -89.74 150.29 22.37 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.399 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.811 ' HB1' HG23 ' A' ' 98' ' ' THR . . . -83.19 117.34 68.3 Favored Pre-proline 0 CA--C 1.508 -0.654 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.978 -176.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.11 63.3 8.21 Favored 'Trans proline' 0 N--CA 1.445 -1.36 0 C-N-CA 121.886 1.724 . . . . 0.0 111.05 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.4 89.63 0.01 OUTLIER 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.837 0.827 . . . . 0.0 111.402 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.402 ' HG3' ' H ' ' A' ' 113' ' ' SER . 13.2 ptt? -93.48 -59.06 2.1 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.001 178.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.402 ' H ' ' HG3' ' A' ' 112' ' ' MET . 74.9 m -164.63 123.93 1.88 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 178.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.619 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.1 OUTLIER -54.04 -34.97 61.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.87 -174.788 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.459 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 21.2 t70 -71.36 -42.68 68.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.948 0.404 . . . . 0.0 110.666 -178.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.02 -38.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.859 0.838 . . . . 0.0 108.93 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.633 HD22 HG21 ' A' ' 98' ' ' THR . 9.5 tp -61.25 -37.1 81.88 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.333 177.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.619 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.0 mt -57.13 -43.7 81.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.474 175.484 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -65.49 -39.29 91.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.464 0.65 . . . . 0.0 109.607 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.423 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -61.46 -41.44 90.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.008 -0.996 . . . . 0.0 111.171 178.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.937 HD11 ' HA ' ' A' ' 94' ' ' SER . 90.1 mt -65.26 -38.58 82.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.953 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.797 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.8 t70 -63.7 -42.14 98.02 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.35 -32.0 57.25 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.368 176.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.787 HG23 HD11 ' A' ' 97' ' ' ILE . 46.5 t -61.82 -47.88 91.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.949 0.404 . . . . 0.0 110.215 174.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 66.3 mt -67.61 -7.45 26.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.82 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.797 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 22.5 mtp85 -103.48 -47.21 4.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.744 -178.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -112.7 -48.83 2.98 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.559 ' HB2' HG12 ' A' ' 124' ' ' VAL . 20.9 m-20 -68.84 -22.37 64.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.123 -174.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.576 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 6.1 t70 -76.35 80.3 3.1 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.432 ' HB3' ' HZ3' ' A' ' 130' ' ' LYS . 0.2 OUTLIER -69.55 -17.96 63.61 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 114.649 -1.159 . . . . 0.0 111.844 -169.09 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -116.85 10.23 14.1 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.928 -172.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.576 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 17.9 m120 53.63 44.63 29.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.579 173.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -99.13 -13.09 19.94 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.199 176.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.02 4.17 78.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.128 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.58 ' HB2' HD21 ' A' ' 87' ' ' LEU . 34.4 m-85 -133.65 176.68 8.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.456 HG23 HD23 ' A' ' 93' ' ' LEU . 8.3 tt -117.6 119.62 62.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.359 0.6 . . . . 0.0 109.73 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -97.53 -178.67 4.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.823 177.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.757 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.5 t80 -56.03 -47.92 76.93 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 123.44 0.463 . . . . 0.0 111.058 -173.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.99 66.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.959 0.409 . . . . 0.0 111.548 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.535 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 50.9 mt-10 -74.27 -53.87 8.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.849 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.757 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.8 p90 -72.84 -28.83 62.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.876 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.39 81.48 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 110.393 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -73.91 -32.16 63.42 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.025 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.449 ' HB3' HG11 ' A' ' 100' ' ' VAL . 9.0 t -81.3 -38.81 26.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.039 -171.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.536 HD11 HE21 ' A' ' 146' ' ' GLN . 4.3 pp -82.58 -13.01 57.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.646 -175.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.536 HE21 HD11 ' A' ' 145' ' ' LEU . 22.6 mm-40 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.862 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.664 ' HE2' ' HG3' ' A' ' 71' ' ' GLU . 95.9 mmm . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.664 0.269 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.44 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 9.0 m -82.4 157.74 67.32 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.428 -178.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.533 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 75.0 Cg_exo -50.76 -48.94 18.43 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.902 2.401 . . . . 0.0 114.255 -173.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -59.92 -49.5 77.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.664 ' HG3' ' HE2' ' A' ' 67' ' ' MET . 5.3 pm0 -71.7 -28.92 64.03 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.737 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.507 HD23 ' HB2' ' A' ' 67' ' ' MET . 11.3 mt -64.27 -21.28 66.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.371 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.533 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 24.1 mt-30 -69.57 -46.31 66.68 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 49.1 tp -65.15 -20.91 66.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.896 173.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.529 ' CE1' ' HE3' ' A' ' 79' ' ' MET . 48.8 t60 -69.67 -43.3 72.81 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 76' ' ' TYR . 4.2 m-30 -65.69 -25.16 67.19 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.594 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 45.1 t80 -75.6 -53.56 8.4 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.039 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.594 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.3 mmmt -79.9 -30.88 40.22 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -173.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.529 ' HE3' ' CE1' ' A' ' 75' ' ' HIS . 17.3 tpp -47.93 -36.29 12.14 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -170.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.822 ' HE1' HD21 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -135.2 8.37 3.43 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -169.015 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.654 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.0 t70 -88.51 73.03 8.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.016 0.913 . . . . 0.0 109.354 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -72.08 -22.37 61.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.313 -175.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -87.06 -15.89 37.24 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.533 -175.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.42 ' HA3' ' OD1' ' A' ' 81' ' ' ASP . . . 62.58 29.69 74.35 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 115.545 -0.752 . . . . 0.0 114.401 175.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -94.19 6.87 47.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 117.783 0.791 . . . . 0.0 111.464 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 69.79 13.65 8.06 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.839 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.518 HD11 ' HB2' ' A' ' 135' ' ' TYR . 1.2 mm? -131.16 152.44 50.44 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.09 0.472 . . . . 0.0 110.309 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.714 HD23 ' CD2' ' A' ' 80' ' ' HIS . 14.5 mt -119.94 109.16 15.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.612 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.613 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 11.1 t70 -75.3 160.93 29.76 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.5 ' HA3' ' HB2' ' A' ' 93' ' ' LEU . . . -53.4 -29.5 38.64 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 121.29 -0.481 . . . . 0.0 112.386 174.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.613 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.8 mt -60.35 -55.26 35.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 110.085 175.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.654 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 34.7 mt-10 -59.37 -53.02 62.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.207 174.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.822 HD21 ' HE1' ' A' ' 80' ' ' HIS . 69.1 mt -55.59 -17.07 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.897 -172.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.872 ' HA ' HD11 ' A' ' 121' ' ' ILE . 15.8 t -52.48 -32.01 37.83 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.362 0.414 . . . . 0.0 111.912 -177.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -29.4 17.43 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.463 ' HB2' ' CE1' ' A' ' 80' ' ' HIS . . . -98.13 -28.07 13.9 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -168.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.716 ' CG1' ' HB3' ' A' ' 93' ' ' LEU . 34.5 mm -66.52 -17.08 21.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.671 0.748 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.765 HG21 HD22 ' A' ' 117' ' ' LEU . 5.6 m -63.22 -17.2 62.18 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.735 172.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.425 ' CE1' ' HB3' ' A' ' 109' ' ' ALA . 98.9 m-70 -112.46 -21.41 11.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.074 0.464 . . . . 0.0 110.088 174.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.668 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.1 t -77.76 -59.39 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.149 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.521 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.4 t60 -80.09 74.05 6.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.399 0.619 . . . . 0.0 109.811 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.595 ' HB2' ' O ' ' A' ' 105' ' ' GLY . 10.1 ptmm? -58.91 153.48 17.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.152 -176.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -142.12 -76.41 0.28 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.62 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.83 ' HG2' ' HB3' ' A' ' 110' ' ' PRO . 7.5 pt-20 -67.64 -44.46 77.89 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.172 0.51 . . . . 0.0 110.444 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.595 ' O ' ' HB2' ' A' ' 102' ' ' LYS . . . -130.91 -155.27 8.17 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 175.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 3.3 p -97.06 -84.48 0.37 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 117.327 0.563 . . . . 0.0 111.139 177.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.2 mp0 -76.71 -22.29 54.1 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 120.814 0.34 . . . . 0.0 111.523 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -69.84 127.11 31.75 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.928 0.394 . . . . 0.0 110.679 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.425 ' HB3' ' CE1' ' A' ' 99' ' ' HIS . . . -66.98 117.85 49.67 Favored Pre-proline 0 CA--C 1.504 -0.815 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.791 -176.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.83 ' HB3' ' HG2' ' A' ' 104' ' ' GLU . 1.1 Cg_endo -83.34 68.73 7.14 Favored 'Trans proline' 0 N--CA 1.432 -2.089 0 C-N-CA 121.708 1.605 . . . . 0.0 111.287 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.07 74.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.049 0.928 . . . . 0.0 110.28 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.449 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.3 ptt? -90.88 -50.75 5.71 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.597 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -159.4 125.45 4.37 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.539 ' O ' HG13 ' A' ' 118' ' ' ILE . 11.5 pt-20 -57.14 -41.88 79.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.391 -176.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -66.34 -50.28 64.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.979 0.418 . . . . 0.0 110.286 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.05 -41.32 78.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.245 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.765 HD22 HG21 ' A' ' 98' ' ' THR . 9.0 tp -63.76 -36.95 85.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 114' ' ' GLU . 87.6 mt -60.57 -44.0 95.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.231 174.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -66.47 -32.26 73.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.047 0.451 . . . . 0.0 110.459 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.521 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.64 -39.01 78.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.572 174.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.872 HD11 ' HA ' ' A' ' 94' ' ' SER . 46.3 mt -74.98 -19.26 16.35 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 CA-C-O 121.191 0.519 . . . . 0.0 110.591 177.506 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 30.2 t70 -74.11 -41.08 62.18 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.6 -35.92 63.31 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 114.588 -1.187 . . . . 0.0 113.211 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.837 HG12 HD13 ' A' ' 125' ' ' LEU . 7.2 p -62.56 -47.17 94.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 CA-C-N 117.529 0.664 . . . . 0.0 110.533 178.703 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.837 HD13 HG12 ' A' ' 124' ' ' VAL . 5.4 mp -70.44 -11.81 61.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.847 0.356 . . . . 0.0 111.379 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.68 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 20.2 mtm180 -92.92 -49.28 6.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -125.8 -26.8 3.43 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.593 ' HB2' HG22 ' A' ' 124' ' ' VAL . 41.8 m-20 -79.14 -28.47 42.83 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.685 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.5 96.41 3.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.578 0.704 . . . . 0.0 109.367 171.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -80.85 -18.75 46.36 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.768 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -78.58 -15.76 58.19 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.062 0.458 . . . . 0.0 110.16 -176.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 66.0 t30 59.67 33.28 21.88 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.601 -173.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -97.88 -16.8 19.6 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.275 -178.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.69 -34.62 5.46 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.687 178.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.518 ' HB2' HD11 ' A' ' 87' ' ' LEU . 6.9 m-85 -114.73 168.84 9.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.46 0.63 . . . . 0.0 111.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.503 HG21 HD11 ' A' ' 88' ' ' LEU . 0.2 OUTLIER -95.59 127.48 47.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.333 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -176.44 3.08 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.255 169.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.793 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.3 t80 -55.4 -48.09 74.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.569 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.22 -27.35 68.61 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.494 ' OE2' ' HA ' ' A' ' 136' ' ' ILE . 56.6 mt-10 -81.66 -47.93 12.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.79 -173.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.793 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.1 p90 -71.13 -30.44 66.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.494 176.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.27 86.47 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.514 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.46 -29.15 52.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.618 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 22.7 t -80.11 -33.94 38.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.398 -172.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.504 HD13 HE21 ' A' ' 146' ' ' GLN . 4.5 pp -79.2 -5.11 53.51 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.842 0.353 . . . . 0.0 111.41 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.504 HE21 HD13 ' A' ' 145' ' ' LEU . 19.1 mm-40 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.51 -0.757 . . . . 0.0 111.274 -177.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.693 ' HB2' HD12 ' A' ' 72' ' ' LEU . 93.0 mmm . . . . . 0 C--O 1.232 0.149 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.457 ' O ' HD11 ' A' ' 72' ' ' LEU . 16.2 m -83.32 155.52 66.46 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.41 -41.36 43.63 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 123.022 2.481 . . . . 0.0 114.152 -172.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -57.56 -39.67 77.2 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.039 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.571 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 4.4 mm-40 -67.72 -44.83 76.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.815 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 10.0 mp -61.29 -21.85 64.32 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.075 -168.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -62.85 -49.68 73.91 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 28.1 tp -68.03 -24.31 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.911 174.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.815 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.4 t60 -67.07 -41.54 86.25 Favored 'General case' 0 C--O 1.225 -0.198 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.719 ' CD1' HG21 ' A' ' 100' ' ' VAL . 4.4 m-30 -72.4 -38.04 68.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.634 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.617 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 51.8 t80 -63.66 -51.55 64.62 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.69 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.587 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 23.7 mmmt -79.01 -19.12 52.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.2 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 16.8 tpp -44.16 -50.44 8.67 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.954 0.784 . . . . 0.0 112.203 -173.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.473 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -130.0 9.97 5.39 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.414 -0.515 . . . . 0.0 111.549 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.696 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.3 t70 -82.46 72.19 9.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.689 0.757 . . . . 0.0 110.09 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.1 13.58 30.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.059 178.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.1 p30 -101.65 -13.71 17.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.835 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 65.18 32.0 82.48 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.561 -0.745 . . . . 0.0 113.3 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -107.52 -4.54 18.3 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.597 0.698 . . . . 0.0 111.763 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.1 m120 68.37 12.31 8.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.027 0.531 . . . . 0.0 112.255 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.526 HD11 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -128.54 164.71 22.22 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.553 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 65.7 mt -126.32 119.26 26.9 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.235 174.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.483 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.3 p30 -99.0 -176.72 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 175.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.21 -36.6 52.86 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.758 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.483 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 46.4 mt -63.52 -47.24 82.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.178 0.513 . . . . 0.0 110.29 -177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.696 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 36.6 mt-10 -69.12 -49.95 52.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.742 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.779 ' HB3' HG12 ' A' ' 97' ' ' ILE . 35.1 mt -63.94 -14.7 55.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.263 -173.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.739 ' HA ' HD11 ' A' ' 121' ' ' ILE . 79.7 p -56.51 -37.54 70.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.859 0.361 . . . . 0.0 111.008 -178.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -91.71 -27.15 18.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.348 0.594 . . . . 0.0 111.141 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.609 ' O ' HG22 ' A' ' 100' ' ' VAL . . . -82.27 -48.51 11.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.605 -172.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.935 HG23 ' HA ' ' A' ' 121' ' ' ILE . 30.4 mm -59.66 -25.75 32.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.954 -174.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.649 HG21 HD22 ' A' ' 117' ' ' LEU . 20.9 m -55.94 -22.23 25.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.132 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -110.8 -11.43 14.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.499 177.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.719 HG21 ' CD1' ' A' ' 76' ' ' TYR . 2.7 t -95.1 -49.42 12.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -175.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.559 ' CD2' HG13 ' A' ' 120' ' ' ILE . 69.8 t60 -73.31 98.54 2.7 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.308 -174.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.451 ' HD2' ' O ' ' A' ' 144' ' ' SER . 0.0 OUTLIER -59.12 134.17 56.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.654 171.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -162.14 -74.79 0.05 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -88.58 -57.71 2.82 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -100.06 -157.57 28.25 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 170.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.41 ' HB2' ' OE1' ' A' ' 107' ' ' GLU . 10.8 m -139.37 -84.99 0.24 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 117.147 0.474 . . . . 0.0 109.863 176.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.41 ' OE1' ' HB2' ' A' ' 106' ' ' SER . 2.7 mp0 -70.55 -49.81 44.11 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.424 0.63 . . . . 0.0 109.979 175.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -68.84 140.17 55.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.741 178.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.492 ' HB1' HG23 ' A' ' 98' ' ' THR . . . -75.48 117.48 63.65 Favored Pre-proline 0 CA--C 1.503 -0.849 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.904 -173.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -84.03 68.95 6.58 Favored 'Trans proline' 0 N--CA 1.431 -2.153 0 C-N-CA 121.288 1.326 . . . . 0.0 111.241 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.63 80.23 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 122.115 0.96 . . . . 0.0 110.782 172.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 10.1 ptt? -92.86 -58.03 2.46 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.315 -178.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.9 m -159.68 122.11 3.43 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.608 ' O ' HG13 ' A' ' 118' ' ' ILE . 5.0 pm0 -56.44 -34.16 66.56 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -74.08 -35.23 64.22 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.204 -0.598 . . . . 0.0 110.135 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -68.63 -39.21 80.87 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.649 HD22 HG21 ' A' ' 98' ' ' THR . 11.6 tp -59.92 -39.02 84.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.296 177.41 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.608 HG13 ' O ' ' A' ' 114' ' ' GLU . 95.9 mt -61.22 -44.86 99.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.742 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -65.65 -32.88 74.7 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 109.987 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.559 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.49 -38.68 76.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.537 175.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.935 ' HA ' HG23 ' A' ' 97' ' ' ILE . 80.1 mt -68.42 -39.6 81.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.411 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.722 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.5 t70 -61.99 -44.85 95.86 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.119 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.11 -34.4 52.76 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.466 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.754 HG22 HG22 ' A' ' 97' ' ' ILE . 47.3 t -65.04 -48.35 84.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.86 0.362 . . . . 0.0 110.414 175.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.436 HD21 ' O ' ' A' ' 134' ' ' GLY . 88.1 mt -67.87 -4.88 14.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.08 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.722 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.4 mtm180 -103.29 -49.21 3.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -120.21 -35.41 3.45 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.625 ' HB2' HG12 ' A' ' 124' ' ' VAL . 26.3 m-20 -78.23 -16.7 57.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.153 0.501 . . . . 0.0 110.288 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.74 90.85 3.44 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.43 ' HB3' ' HZ3' ' A' ' 130' ' ' LYS . 0.1 OUTLIER -76.42 -17.04 59.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.731 -167.451 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -119.94 17.95 12.52 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 54.71 40.23 31.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.442 172.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 p30 -102.53 -11.49 18.49 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.261 177.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.436 ' O ' HD21 ' A' ' 125' ' ' LEU . . . 84.16 1.15 89.63 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.617 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.526 ' HB2' HD11 ' A' ' 87' ' ' LEU . 13.8 m-85 -127.59 178.86 5.83 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.642 HG23 HD23 ' A' ' 93' ' ' LEU . 3.7 tt -121.41 125.53 73.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -103.14 -177.62 3.43 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.104 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.88 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 15.2 t80 -56.66 -48.82 76.76 Favored 'General case' 0 C--O 1.227 -0.128 0 O-C-N 123.3 0.375 . . . . 0.0 110.838 -175.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.19 -21.91 64.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.694 0.283 . . . . 0.0 111.558 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -78.52 -56.78 4.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.88 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -67.63 -32.08 72.54 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.855 -0.738 . . . . 0.0 110.097 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.61 -39.95 78.04 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.953 0.406 . . . . 0.0 110.421 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.443 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.3 mtmm -75.34 -28.11 59.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.961 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.451 ' O ' ' HD2' ' A' ' 102' ' ' LYS . 23.2 t -79.21 -19.01 51.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.803 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 68.3 mt -87.12 8.55 23.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.415 178.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.227 -179.607 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.621 ' HE1' ' HG3' ' A' ' 71' ' ' GLU . 98.9 mmm . . . . . 0 N--CA 1.464 0.24 0 CA-C-O 121.142 0.496 . . . . 0.0 111.732 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.524 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 17.2 m -93.16 163.41 25.24 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.742 -178.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.576 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.6 Cg_exo -53.34 -49.92 15.76 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.809 2.339 . . . . 0.0 113.969 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.551 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 2.1 pt20 -61.77 -49.94 74.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.068 -176.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.621 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 0.8 OUTLIER -61.27 -43.34 99.03 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.675 175.077 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.539 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 12.3 mt -62.44 -22.85 66.52 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.702 -173.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.813 ' HG2' HD22 ' A' ' 145' ' ' LEU . 21.1 mt-30 -71.3 -39.67 71.32 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 175.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.51 -24.67 65.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.384 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.539 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 59.3 t60 -65.88 -46.43 78.43 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 175.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.449 ' CD1' HD23 ' A' ' 145' ' ' LEU . 3.3 m-30 -63.69 -33.65 76.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.189 0.519 . . . . 0.0 109.64 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.495 ' HA ' HD12 ' A' ' 88' ' ' LEU . 65.2 t80 -65.62 -51.91 56.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.204 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.429 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 27.4 mmmt -79.69 -15.5 57.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.547 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.43 ' HE2' ' HA ' ' A' ' 79' ' ' MET . 2.4 tpt -45.2 -44.29 10.84 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.597 0.759 . . . . 0.0 112.519 -170.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.855 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -137.41 10.29 2.96 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.706 -177.569 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.7 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.1 t70 -83.2 88.69 6.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.243 0.544 . . . . 0.0 110.21 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.435 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 26.7 m-85 -110.46 -0.91 17.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.149 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -87.64 -14.68 39.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.582 -174.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.97 78.0 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 121.162 -0.542 . . . . 0.0 113.425 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -95.41 -5.4 43.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 117.706 0.753 . . . . 0.0 111.311 -177.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 64.84 18.25 11.38 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.177 0.591 . . . . 0.0 112.033 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.546 HD11 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -130.4 167.76 18.06 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 172.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 77' ' ' PHE . 68.1 mt -131.04 117.28 18.93 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.813 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -93.76 -178.93 4.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.143 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -56.68 -33.89 63.64 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.128 -0.558 . . . . 0.0 113.331 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 19.9 mt -69.55 -48.38 60.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.176 0.512 . . . . 0.0 109.932 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.855 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 45.6 mt-10 -62.99 -49.24 75.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.886 0.85 . . . . 0.0 109.39 174.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.781 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.2 mt -66.57 -9.84 39.31 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.924 -1.034 . . . . 0.0 113.407 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.991 ' HA ' HD11 ' A' ' 121' ' ' ILE . 34.6 t -54.57 -31.64 57.03 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.024 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.05 -36.75 13.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 0.0 111.339 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.49 -39.26 22.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.845 -168.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.781 HG12 ' HB3' ' A' ' 93' ' ' LEU . 39.1 mm -67.87 -16.33 20.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.959 0.409 . . . . 0.0 111.16 -176.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.46 HG21 HD22 ' A' ' 117' ' ' LEU . 8.7 m -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.471 175.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -102.86 -23.72 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.275 174.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.738 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 73.4 t -77.97 -63.8 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.729 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.467 ' CD2' HG13 ' A' ' 120' ' ' ILE . 13.3 t60 -82.84 86.04 6.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.249 0.547 . . . . 0.0 110.324 -176.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.512 ' HE2' ' O ' ' A' ' 144' ' ' SER . 0.0 OUTLIER -111.67 176.71 4.91 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.708 -177.724 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -124.15 -39.82 2.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.684 175.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -122.28 -42.28 2.37 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -80.84 178.82 53.86 Favored Glycine 0 C--O 1.226 -0.371 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.438 -177.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.9 m -131.28 -84.14 0.51 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 173.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -76.93 -2.41 33.52 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.537 0.684 . . . . 0.0 110.3 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -101.95 116.52 32.88 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.909 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.459 ' HB1' HG23 ' A' ' 98' ' ' THR . . . -71.85 118.88 70.68 Favored Pre-proline 0 CA--C 1.507 -0.688 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.302 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -89.41 67.72 2.31 Favored 'Trans proline' 0 N--CA 1.432 -2.132 0 C-N-CA 122.015 1.81 . . . . 0.0 111.177 175.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 52.7 tp -59.0 84.25 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.792 0.806 . . . . 0.0 110.781 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 15.5 ptt? -81.96 -55.95 4.27 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.86 -178.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.9 m -162.09 118.72 2.06 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.559 ' O ' HG13 ' A' ' 118' ' ' ILE . 2.5 pm0 -57.47 -34.82 69.41 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -173.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -69.9 -42.6 73.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 109.946 -178.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.32 -37.26 80.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.292 175.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.502 ' O ' HG13 ' A' ' 121' ' ' ILE . 11.7 tp -61.89 -36.45 81.32 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.956 177.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 114' ' ' GLU . 61.8 mt -57.7 -47.4 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.436 174.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -67.14 -27.01 66.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 176.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.472 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -69.66 -38.49 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.695 175.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.991 HD11 ' HA ' ' A' ' 94' ' ' SER . 76.1 mt -74.78 -18.29 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.536 0.684 . . . . 0.0 109.806 176.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.657 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 4.5 m-20 -75.35 -42.41 54.27 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 166.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.4 -38.26 68.83 Favored Glycine 0 C--O 1.227 -0.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.037 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.698 HG22 ' HB2' ' A' ' 128' ' ' ASP . 7.5 p -59.34 -49.19 84.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 117.468 0.634 . . . . 0.0 109.765 176.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.5 mt -69.89 -8.39 48.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.221 0.534 . . . . 0.0 111.269 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.657 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 39.7 mmt-85 -100.56 -31.91 11.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.499 -179.498 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.36 -48.9 0.78 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.698 ' HB2' HG22 ' A' ' 124' ' ' VAL . 32.8 m-20 -65.96 -25.99 67.36 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.492 0.663 . . . . 0.0 110.137 -177.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.823 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -72.42 90.8 1.32 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.924 -1.034 . . . . 0.0 108.735 168.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.465 ' HB3' ' HZ3' ' A' ' 130' ' ' LYS . 0.4 OUTLIER -77.84 -29.8 50.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.523 -169.008 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -90.86 -6.05 54.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.333 0.587 . . . . 0.0 111.024 -177.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.823 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 9.5 m120 55.95 49.46 15.8 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.353 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 p30 -95.22 -8.1 37.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.199 175.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 -1.3 85.49 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.45 177.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.546 ' HB2' HD11 ' A' ' 87' ' ' LEU . 24.1 m-85 -131.42 176.03 8.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 109.983 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.515 HD11 ' CG2' ' A' ' 124' ' ' VAL . 10.1 tt -112.09 118.7 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.796 0.808 . . . . 0.0 110.507 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -93.58 170.65 9.43 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.583 177.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.863 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.2 t80 -46.62 -54.94 8.46 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.061 0.544 . . . . 0.0 111.224 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.19 -25.88 68.54 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.021 0.439 . . . . 0.0 111.839 -176.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.505 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -77.81 -52.76 8.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.937 -175.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.863 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -72.64 -31.07 64.83 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.644 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.76 -40.54 79.98 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.889 0.376 . . . . 0.0 110.791 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -76.94 -29.25 55.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.333 177.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.512 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 22.7 t -82.8 -38.15 23.51 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.025 -170.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.813 HD22 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp -77.55 -26.19 50.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.662 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.512 ' C ' ' HZ3' ' A' ' 102' ' ' LYS . 18.6 mm-40 . . . . . 0 C--O 1.242 0.667 0 CA-C-O 118.845 -0.597 . . . . 0.0 111.44 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.624 ' HB2' HD23 ' A' ' 72' ' ' LEU . 88.6 mmm . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.45 ' HG ' ' CD ' ' A' ' 71' ' ' GLU . 2.9 p -116.22 159.65 38.85 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 121.348 -0.141 . . . . 0.0 111.168 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.506 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 82.6 Cg_exo -49.33 -39.79 43.66 Favored 'Trans proline' 0 N--CA 1.481 0.741 0 C-N-CA 123.608 2.872 . . . . 0.0 115.511 -169.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.416 ' HA ' HE21 ' A' ' 73' ' ' GLN . 0.0 OUTLIER -57.56 -54.79 42.89 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 121.227 0.537 . . . . 0.0 110.648 -175.543 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.594 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 1.9 pm0 -76.99 -27.17 54.62 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.886 177.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.624 HD23 ' HB2' ' A' ' 67' ' ' MET . 14.0 mt -65.57 -17.56 64.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 120.875 0.369 . . . . 0.0 111.502 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.538 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 44.4 mt-30 -71.23 -47.93 54.28 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 171.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.5 -22.49 63.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.016 172.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.542 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 68.7 t60 -67.15 -37.07 83.15 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.329 176.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.515 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 3.8 m-30 -70.34 -34.62 72.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.483 0.659 . . . . 0.0 109.394 177.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.665 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 55.5 t80 -67.78 -52.3 38.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.913 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.665 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.2 mmmt -79.34 -14.81 58.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.381 -175.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.0 OUTLIER -45.33 -38.11 5.46 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 124.052 0.845 . . . . 0.0 111.816 -174.401 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -142.81 9.52 1.75 Allowed 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.713 178.955 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.477 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.7 t70 -85.21 79.51 9.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.863 0.84 . . . . 0.0 109.829 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 -11.22 24.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.7 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -90.14 -14.71 33.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.526 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.88 24.57 66.82 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.328 -0.851 . . . . 0.0 114.92 171.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -87.67 5.23 40.7 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.545 1.172 . . . . 0.0 111.012 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.533 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 11.3 m120 70.3 5.74 5.47 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.678 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 135' ' ' TYR . 3.7 mm? -121.22 145.56 47.72 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.296 0.57 . . . . 0.0 109.932 175.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.473 ' HB3' ' HG ' ' A' ' 93' ' ' LEU . 3.6 mm? -107.44 110.71 22.73 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.149 174.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.58 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.4 p30 -84.64 -174.1 5.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.189 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.08 -47.43 66.94 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.093 0.397 . . . . 0.0 114.093 -176.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.665 HD11 ' N ' ' A' ' 92' ' ' GLU . 3.8 pp -77.14 -28.16 54.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.599 0.699 . . . . 0.0 110.641 -175.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.665 ' N ' HD11 ' A' ' 91' ' ' LEU . 45.5 mt-10 -65.98 -55.08 18.57 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 172.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.924 ' HB3' HG12 ' A' ' 97' ' ' ILE . 32.7 mt -64.21 -12.58 42.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.198 -178.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.681 ' HA ' HD11 ' A' ' 121' ' ' ILE . 39.4 m -55.12 -34.13 63.45 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.595 0.236 . . . . 0.0 111.617 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -92.81 -31.49 15.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.19 0.519 . . . . 0.0 111.225 174.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.419 ' HB1' ' HA ' ' A' ' 93' ' ' LEU . . . -80.04 -42.31 24.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.222 -170.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.924 HG12 ' HB3' ' A' ' 93' ' ' LEU . 41.2 mm -62.7 -25.2 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 111.055 -176.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.622 HG23 ' HB2' ' A' ' 109' ' ' ALA . 2.7 m -58.69 -18.61 32.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.58 176.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.515 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 72.9 m-70 -115.51 -33.47 5.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.369 172.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.858 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 39.1 t -58.91 -55.46 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 40.2 t60 -74.32 80.4 1.85 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.436 0.636 . . . . 0.0 110.348 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.454 ' HE3' ' O ' ' A' ' 106' ' ' SER . 79.0 tttt -57.66 134.85 56.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.55 -1.205 . . . . 0.0 111.271 -178.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -154.31 -66.56 0.14 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.521 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -80.3 -64.97 1.07 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.063 -174.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.477 ' HA2' ' HG2' ' A' ' 108' ' ' GLN . . . -104.85 -166.41 24.23 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.894 -175.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.454 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 37.6 t -73.67 -75.07 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -118.83 -6.33 10.57 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.42 0.628 . . . . 0.0 110.087 177.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.477 ' HG2' ' HA2' ' A' ' 105' ' ' GLY . 6.3 pt20 -61.6 156.69 19.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.589 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.622 ' HB2' HG23 ' A' ' 98' ' ' THR . . . -85.14 114.34 55.49 Favored Pre-proline 0 CA--C 1.507 -0.698 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.491 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.442 ' HD3' ' O ' ' A' ' 108' ' ' GLN . 4.4 Cg_exo -74.48 61.38 5.2 Favored 'Trans proline' 0 N--CA 1.448 -1.203 0 C-N-CA 121.904 1.736 . . . . 0.0 110.848 172.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.8 tp -71.67 74.54 0.82 Allowed 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 122.185 0.993 . . . . 0.0 110.578 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.403 ' C ' ' HG ' ' A' ' 113' ' ' SER . 10.0 ptt? -75.61 -53.61 8.31 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.268 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.403 ' HG ' ' C ' ' A' ' 112' ' ' MET . 49.0 m -159.86 122.9 3.52 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 175.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.573 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -61.09 -33.97 74.2 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -170.179 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.61 -40.71 76.46 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.215 0.531 . . . . 0.0 110.37 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.0 tt0 -68.85 -36.69 78.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.848 0.832 . . . . 0.0 109.56 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.484 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.4 tm? -63.94 -36.81 85.17 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.612 177.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.573 HG13 ' O ' ' A' ' 114' ' ' GLU . 70.1 mt -62.52 -38.95 82.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.669 174.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -64.5 -40.45 95.67 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 174.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.64 -39.35 79.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.595 175.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.819 ' HA ' HG23 ' A' ' 97' ' ' ILE . 76.0 mt -59.85 -47.91 89.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.284 175.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.782 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 34.7 t70 -61.49 -39.89 92.58 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.66 -31.21 52.97 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.873 175.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.762 HG22 HD11 ' A' ' 97' ' ' ILE . 42.9 t -68.25 -49.22 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.291 -0.262 . . . . 0.0 110.291 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 134' ' ' GLY . 8.8 mp -63.63 -10.34 18.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.018 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.782 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 24.2 mtm-85 -102.31 -49.24 3.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -113.45 -45.1 3.15 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -172.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.572 ' HB2' HG12 ' A' ' 124' ' ' VAL . 10.1 m-20 -68.91 -24.09 64.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.898 0.38 . . . . 0.0 110.682 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.538 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.9 t70 -74.68 93.52 2.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.88 0.847 . . . . 0.0 108.962 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -79.08 -18.88 52.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.167 -172.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -2.35 43.9 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.202 -171.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.3 t30 60.64 32.91 20.4 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.389 -177.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -99.0 -1.98 38.45 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 121.061 0.458 . . . . 0.0 110.067 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.443 ' O ' ' HG ' ' A' ' 125' ' ' LEU . . . 82.02 -24.42 4.65 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.735 -0.666 . . . . 0.0 113.35 173.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.516 ' HB2' HD11 ' A' ' 87' ' ' LEU . 18.5 m-85 -116.48 -179.19 3.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.932 0.396 . . . . 0.0 110.59 -176.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.697 HG12 ' HG3' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -110.82 129.73 65.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.388 0.613 . . . . 0.0 112.091 179.206 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.435 ' H ' ' HG2' ' A' ' 140' ' ' GLU . 12.2 t70 -103.11 168.09 9.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.473 172.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.869 ' HA ' ' CE2' ' A' ' 141' ' ' PHE . 21.5 t80 -50.86 -44.05 59.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.718 0.294 . . . . 0.0 110.834 -177.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.447 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -67.81 -31.31 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -173.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.697 ' HG3' HG12 ' A' ' 136' ' ' ILE . 12.7 pt-20 -91.19 -30.06 16.88 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.508 -169.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.869 ' CE2' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -76.11 -32.06 58.99 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.21 171.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.518 ' O ' ' HG2' ' A' ' 146' ' ' GLN . . . -64.13 -43.02 96.57 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.407 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.0 mtmt -72.77 -28.78 62.81 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.351 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.3 t -70.04 -35.15 74.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.943 0.401 . . . . 0.0 110.274 -177.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.548 HD13 HE21 ' A' ' 146' ' ' GLN . 4.3 pp -86.22 10.77 13.66 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.475 -177.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.548 HE21 HD13 ' A' ' 145' ' ' LEU . 27.7 mm-40 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.335 -0.841 . . . . 0.0 110.425 177.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.788 ' HB2' HD23 ' A' ' 72' ' ' LEU . 98.2 mmm . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.715 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 26.6 m -98.4 139.4 21.15 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-O 120.997 0.427 . . . . 0.0 110.625 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.646 ' HA ' ' HB2' ' A' ' 72' ' ' LEU . 73.3 Cg_exo -50.92 -27.97 22.49 Favored 'Trans proline' 0 N--CA 1.477 0.51 0 C-N-CA 124.085 3.19 . . . . 0.0 115.15 -172.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -65.06 -51.32 62.18 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-O 120.731 0.301 . . . . 0.0 111.017 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.715 ' HG2' ' O ' ' A' ' 68' ' ' SER . 3.0 pm0 -72.33 -26.36 61.9 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.09 173.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.788 HD23 ' HB2' ' A' ' 67' ' ' MET . 39.5 mt -66.82 -17.5 64.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.688 0.28 . . . . 0.0 111.627 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.569 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 42.4 mt-30 -73.08 -40.97 64.58 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 171.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.2 tp -66.88 -21.88 65.99 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 171.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.579 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 5.0 t60 -66.91 -35.0 79.01 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.103 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.575 ' OH ' ' HA ' ' A' ' 107' ' ' GLU . 4.0 m-30 -72.1 -33.58 67.97 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.534 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 54.3 t80 -67.09 -53.08 34.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.154 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.531 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.9 mmmt -80.53 -11.12 59.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.596 -176.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.417 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 3.5 tpt -43.12 -43.41 4.47 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.069 0.856 . . . . 0.0 112.005 -172.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.519 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -141.06 10.06 2.14 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.88 179.332 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.735 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 34.2 t70 -82.07 80.7 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.31 0.576 . . . . 0.0 110.854 -176.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.519 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 3.9 m-85 -108.32 -6.11 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.738 178.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.5 p30 -75.8 -13.68 60.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.734 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.67 23.66 72.13 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 116.025 -0.534 . . . . 0.0 113.464 175.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -108.41 -8.65 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.616 0.708 . . . . 0.0 110.964 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.445 ' HB3' ' HZ ' ' A' ' 77' ' ' PHE . 13.1 m120 64.41 20.58 12.21 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.564 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 135' ' ' TYR . 2.9 mm? -127.89 157.04 41.6 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.544 ' HB3' ' HB2' ' A' ' 93' ' ' LEU . 83.2 mt -113.2 110.82 21.03 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.045 0.45 . . . . 0.0 111.537 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.525 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 8.0 t70 -83.31 161.45 21.42 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.565 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -44.59 -56.14 5.77 Favored Glycine 0 N--CA 1.464 0.514 0 N-CA-C 114.909 0.723 . . . . 0.0 114.909 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.677 HD11 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -73.55 -30.99 63.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.644 0.722 . . . . 0.0 111.262 -174.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.735 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.7 tt0 -69.61 -58.62 3.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.292 1.044 . . . . 0.0 108.768 176.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.917 ' HG ' HG12 ' A' ' 97' ' ' ILE . 40.7 tp -61.92 -10.44 9.5 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.755 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.775 ' HA ' HD11 ' A' ' 121' ' ' ILE . 18.8 m -51.94 -32.37 32.76 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.143 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.1 m -85.76 -27.34 25.28 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.531 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.527 ' HB2' HD11 ' A' ' 93' ' ' LEU . . . -85.17 -37.89 19.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -172.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.917 HG12 ' HG ' ' A' ' 93' ' ' LEU . 46.1 mm -64.3 -21.76 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 CA-C-O 120.902 0.382 . . . . 0.0 111.037 -177.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.592 HG23 ' HB1' ' A' ' 109' ' ' ALA . 4.2 m -57.58 -31.09 65.81 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.972 174.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.452 ' ND1' ' HB2' ' A' ' 109' ' ' ALA . 98.7 m-70 -101.42 -32.97 10.18 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.555 176.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.814 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 36.7 t -56.89 -52.42 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.486 0.184 . . . . 0.0 110.875 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -69.23 81.18 0.35 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.216 171.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 145' ' ' LEU . 1.3 pptp? -64.54 153.64 38.5 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.862 176.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -144.88 -67.85 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.845 0.355 . . . . 0.0 110.67 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -90.69 -10.18 44.06 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.405 0.621 . . . . 0.0 110.372 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.454 ' HA2' ' OE1' ' A' ' 108' ' ' GLN . . . -175.45 174.12 46.64 Favored Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 178.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 19.8 m -67.65 -66.66 0.53 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.557 0.679 . . . . 0.0 110.771 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.575 ' HA ' ' OH ' ' A' ' 76' ' ' TYR . 31.4 mm-40 -73.26 -17.64 61.31 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.368 0.604 . . . . 0.0 110.938 -179.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.454 ' OE1' ' HA2' ' A' ' 105' ' ' GLY . 51.9 mt-30 -71.52 107.57 4.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.483 -176.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.592 ' HB1' HG23 ' A' ' 98' ' ' THR . . . -76.83 122.92 87.3 Favored Pre-proline 0 CA--C 1.502 -0.878 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.339 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -83.04 67.1 7.79 Favored 'Trans proline' 0 N--CA 1.436 -1.862 0 C-N-CA 121.555 1.503 . . . . 0.0 111.305 175.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.22 79.61 0.05 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.368 1.08 . . . . 0.0 109.852 173.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.471 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.0 ptt? -92.15 -58.35 2.42 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 113.631 -1.622 . . . . 0.0 110.436 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.404 ' H ' ' CG ' ' A' ' 112' ' ' MET . 47.6 m -161.02 120.95 2.68 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.487 ' O ' HG13 ' A' ' 118' ' ' ILE . 9.2 pt-20 -56.39 -27.03 55.11 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -174.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.84 -47.18 78.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.375 0.607 . . . . 0.0 110.12 176.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.19 -38.8 85.97 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.435 HD13 ' HG1' ' A' ' 98' ' ' THR . 0.4 OUTLIER -60.65 -38.69 85.69 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.355 178.771 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 114' ' ' GLU . 30.9 mt -59.39 -50.62 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.517 174.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.2 -33.01 74.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.132 0.491 . . . . 0.0 110.357 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.2 mp -63.73 -45.68 96.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.01 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.823 ' HA ' HG23 ' A' ' 97' ' ' ILE . 71.7 mt -62.94 -44.94 99.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 121.141 0.496 . . . . 0.0 109.705 176.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.762 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.7 t70 -57.55 -44.55 85.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.429 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.46 -31.77 60.28 Favored Glycine 0 C--N 1.334 0.453 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.448 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.78 HG22 HD11 ' A' ' 97' ' ' ILE . 44.5 t -63.39 -51.62 68.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.271 173.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.62 -6.82 22.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.275 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.762 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 19.7 mtm180 -101.64 -47.77 4.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.045 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -115.56 -44.88 2.93 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.479 ' HB2' HG11 ' A' ' 124' ' ' VAL . 17.4 m-20 -70.96 -22.06 62.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.025 0.44 . . . . 0.0 111.049 -177.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -80.12 84.34 5.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -71.55 -26.65 62.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.756 -174.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . 0.475 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.6 m120 -76.45 -14.72 60.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.305 -173.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.7 t30 63.41 25.94 14.75 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.663 0.744 . . . . 0.0 109.221 -175.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.475 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -92.47 -15.0 27.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.837 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.5 -25.34 28.43 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.9 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.525 ' CD2' ' HA ' ' A' ' 89' ' ' ASP . 14.2 m-85 -116.42 162.79 17.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.176 -176.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.523 HG23 ' HB2' ' A' ' 88' ' ' LEU . 7.3 tt -96.65 130.89 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.465 0.65 . . . . 0.0 110.263 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -103.02 172.03 7.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.53 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.802 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 11.2 t80 -53.25 -48.03 68.57 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 123.135 0.272 . . . . 0.0 110.752 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.408 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -64.44 -31.21 72.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.485 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -75.87 -52.43 10.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.573 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.802 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.0 p90 -70.16 -28.05 65.02 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.397 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.57 -40.37 96.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 120.941 0.401 . . . . 0.0 110.447 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.8 mtmt -74.14 -28.81 61.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.762 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 13.7 t -80.94 -33.86 33.72 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.97 -174.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 102' ' ' LYS . 4.0 pp -83.39 -42.05 17.46 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.336 -0.228 . . . . 0.0 111.502 -178.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.809 179.277 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.616 ' HE1' ' HG3' ' A' ' 71' ' ' GLU . 91.7 mmm . . . . . 0 N--CA 1.464 0.256 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.474 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -93.9 161.34 30.28 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.537 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 10.1 Cg_endo -52.29 -46.62 31.64 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.145 2.563 . . . . 0.0 113.82 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -61.63 -50.28 73.17 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.252 -172.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.616 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 7.8 pm0 -71.97 -28.94 63.76 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.398 176.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.498 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 13.0 mt -66.76 -21.13 66.07 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.3 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.537 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 24.8 mt-30 -69.35 -46.46 66.95 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 173.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.47 -21.93 66.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.757 172.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.65 ' CE1' ' HE3' ' A' ' 79' ' ' MET . 25.5 t60 -69.99 -44.29 69.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.175 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.602 ' HE2' ' CD2' ' A' ' 145' ' ' LEU . 5.3 m-30 -67.58 -26.82 66.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.527 0.68 . . . . 0.0 109.371 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.47 ' HA ' HD13 ' A' ' 88' ' ' LEU . 48.6 t80 -74.87 -52.61 10.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 114.526 -1.215 . . . . 0.0 109.989 179.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.574 ' HE3' ' HA ' ' A' ' 78' ' ' LYS . 19.7 mmmt -81.15 -24.63 37.44 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -174.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.65 ' HE3' ' CE1' ' A' ' 75' ' ' HIS . 18.2 tpp -44.84 -46.06 10.53 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -172.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.712 ' CD2' ' HB3' ' A' ' 92' ' ' GLU . 1.8 p-80 -130.26 8.28 5.08 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.578 -169.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.642 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 29.3 t70 -84.49 64.84 8.64 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.961 0.886 . . . . 0.0 109.357 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -95.66 3.29 54.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.627 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -89.27 -14.24 36.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.14 26.63 71.84 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.557 -0.747 . . . . 0.0 113.85 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -109.03 -1.74 18.68 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.714 0.757 . . . . 0.0 112.259 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 67.99 14.31 9.32 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.365 0.416 . . . . 0.0 111.512 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.496 HD11 ' HB2' ' A' ' 135' ' ' TYR . 1.8 mm? -126.35 155.25 42.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.654 HD23 ' NE2' ' A' ' 80' ' ' HIS . 17.8 mt -111.69 113.63 26.12 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.201 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.27 176.12 6.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.546 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.03 -51.88 47.03 Favored Glycine 0 CA--C 1.518 0.223 0 N-CA-C 114.238 0.455 . . . . 0.0 114.238 -178.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.596 HD11 ' N ' ' A' ' 92' ' ' GLU . 4.0 pp -73.81 -26.28 60.53 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.359 0.579 . . . . 0.0 110.77 -173.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.712 ' HB3' ' CD2' ' A' ' 80' ' ' HIS . 46.9 mt-10 -65.0 -54.8 24.69 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 122.112 0.958 . . . . 0.0 108.509 168.163 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 97' ' ' ILE . 57.1 mt -60.46 -10.04 4.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.077 -1.419 . . . . 0.0 112.53 -175.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.634 ' HA ' HD11 ' A' ' 121' ' ' ILE . 85.0 p -51.49 -33.08 29.93 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.54 0.525 . . . . 0.0 111.55 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -90.26 -33.33 16.18 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.505 ' HB2' ' HE1' ' A' ' 80' ' ' HIS . . . -93.96 -32.21 13.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -168.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.862 HG12 ' HB3' ' A' ' 93' ' ' LEU . 35.3 mm -65.4 -23.18 32.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.267 0.556 . . . . 0.0 110.445 -177.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.741 HG21 HD23 ' A' ' 117' ' ' LEU . 13.4 m -60.07 -17.84 42.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.9 174.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -110.59 -38.3 5.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.032 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.757 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 54.9 t -56.85 -59.53 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.116 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.409 ' CD2' HG13 ' A' ' 120' ' ' ILE . 7.7 t60 -85.47 65.35 9.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.401 0.62 . . . . 0.0 109.423 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.47 ' HE3' ' O ' ' A' ' 144' ' ' SER . 20.2 pttp -59.47 161.61 5.65 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.397 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -140.7 -80.53 0.26 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.957 -179.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -75.89 -60.48 2.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.869 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.459 ' O ' ' HB2' ' A' ' 102' ' ' LYS . . . -83.99 165.44 41.68 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 174.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.41 ' HA ' ' HD2' ' A' ' 102' ' ' LYS . 19.9 m -95.02 -61.23 1.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.937 0.399 . . . . 0.0 110.739 -177.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -108.5 3.86 23.57 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.742 0.782 . . . . 0.0 110.228 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.454 ' CG ' ' HA2' ' A' ' 105' ' ' GLY . 4.4 pt20 -105.54 147.3 28.52 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.712 177.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.07 116.96 61.81 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-O 120.506 0.193 . . . . 0.0 111.002 -176.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -91.38 69.37 1.1 Allowed 'Trans proline' 0 N--CA 1.435 -1.921 0 C-N-CA 122.231 1.954 . . . . 0.0 111.678 175.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.8 mt -51.1 93.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.669 0.747 . . . . 0.0 110.967 173.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -100.82 -55.29 2.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.623 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.7 m -160.74 118.28 2.43 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.496 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.7 OUTLIER -55.41 -36.64 66.67 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -174.541 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -67.57 -49.67 62.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.108 0.48 . . . . 0.0 110.154 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.28 -36.93 74.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.202 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.741 HD23 HG21 ' A' ' 98' ' ' THR . 9.8 tp -66.44 -41.09 89.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.323 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.2 mt -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.392 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -70.77 -31.47 68.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.431 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.409 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.0 OUTLIER -62.02 -38.54 81.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.273 175.911 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.835 ' HA ' HG23 ' A' ' 97' ' ' ILE . 80.1 mt -64.08 -41.6 92.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.914 176.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.697 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.1 t70 -62.3 -44.1 97.3 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.613 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.91 -30.24 56.65 Favored Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.492 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.802 HG23 HD11 ' A' ' 97' ' ' ILE . 42.7 t -63.67 -50.49 77.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.996 0.427 . . . . 0.0 110.362 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.27 -6.25 22.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.051 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.697 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 27.8 mtm-85 -98.88 -48.47 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.055 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -121.27 -39.65 2.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.534 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 21.6 m-20 -67.48 -21.89 65.49 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.031 0.443 . . . . 0.0 110.967 -178.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.521 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.7 t70 -76.1 92.64 3.23 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 166.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -78.96 -27.69 43.58 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.471 -168.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.51 4.84 36.34 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.974 -170.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.521 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 65.0 t30 57.35 53.29 7.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.133 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -108.49 -3.86 17.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.773 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.15 -18.9 37.92 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.94 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.496 ' HB2' HD11 ' A' ' 87' ' ' LEU . 48.8 m-85 -117.36 177.34 4.77 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.878 0.37 . . . . 0.0 110.025 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.501 HD12 ' HB3' ' A' ' 141' ' ' PHE . 6.3 tt -113.38 123.52 69.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.403 0.62 . . . . 0.0 109.492 174.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -101.62 -179.34 3.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.836 177.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.866 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 9.4 t80 -52.2 -51.19 59.65 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.579 0.549 . . . . 0.0 111.476 -173.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.54 -22.04 64.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -175.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.433 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 52.6 mt-10 -80.08 -50.8 9.83 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -174.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.866 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 5.0 p90 -71.44 -33.59 69.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.84 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.12 77.16 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.848 0.356 . . . . 0.0 110.821 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -73.08 -29.22 62.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.111 176.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.47 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 7.7 t -81.14 -18.9 44.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -174.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.739 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 91.3 mt -85.51 1.43 48.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.989 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 . . . . . 0 C--O 1.243 0.759 0 CA-C-O 118.668 -0.682 . . . . 0.0 110.303 179.327 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.689 ' HB2' ' CD1' ' A' ' 72' ' ' LEU . 85.6 mmm . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.405 ' O ' HD11 ' A' ' 72' ' ' LEU . 14.8 m -96.69 153.45 38.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.166 177.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -49.36 -43.1 39.28 Favored 'Trans proline' 0 N--CA 1.479 0.657 0 C-N-CA 122.931 2.421 . . . . 0.0 113.573 -173.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -56.72 -44.87 82.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.055 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -64.93 -43.8 91.58 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.279 174.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.689 ' CD1' ' HB2' ' A' ' 67' ' ' MET . 7.7 mp -57.2 -24.8 56.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -169.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.601 ' HG2' HD23 ' A' ' 145' ' ' LEU . 10.2 mt-30 -63.9 -50.42 68.81 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 173.473 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 34.2 tp -63.49 -24.07 67.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.011 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.559 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 13.7 t60 -66.62 -38.25 86.54 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 4.3 m-30 -71.92 -37.02 70.13 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.643 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 48.7 t80 -62.16 -52.75 62.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.943 178.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -80.24 -13.66 59.05 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.57 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.63 -45.83 9.8 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 124.044 0.84 . . . . 0.0 111.069 -171.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.492 ' CD2' ' HE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -139.54 9.97 2.46 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.966 -178.634 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.744 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 26.2 t70 -85.07 82.96 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.892 0.853 . . . . 0.0 109.758 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.492 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.7 OUTLIER -121.63 15.17 11.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.144 -177.254 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -95.12 -13.33 25.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.219 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 12.14 80.59 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.249 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -98.34 -4.15 35.55 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 117.394 0.597 . . . . 0.0 111.065 -178.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 58.38 34.4 23.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.605 176.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' A' ' 135' ' ' TYR . 7.9 mt -151.54 149.37 29.12 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.563 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.543 HD12 ' HA ' ' A' ' 77' ' ' PHE . 68.8 mt -94.81 113.21 24.94 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.973 0.416 . . . . 0.0 111.823 -177.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.48 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 8.9 t70 -91.71 167.0 12.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.391 177.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.86 -49.93 39.82 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.648 HD11 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -68.92 -29.22 67.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 117.413 0.606 . . . . 0.0 110.631 -176.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.744 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 50.8 mt-10 -69.83 -48.54 58.58 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.815 ' HB3' HG12 ' A' ' 97' ' ' ILE . 25.2 mt -65.26 -11.24 39.3 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.31 -178.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.647 ' HA ' HD11 ' A' ' 121' ' ' ILE . 65.9 m -58.46 -33.35 69.65 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.832 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -93.35 -27.67 16.63 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.217 0.532 . . . . 0.0 111.482 174.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.51 -41.43 14.36 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -169.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.838 HG23 ' HA ' ' A' ' 121' ' ' ILE . 43.0 mm -64.43 -21.13 28.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.012 0.434 . . . . 0.0 110.692 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.635 HG21 HD22 ' A' ' 117' ' ' LEU . 2.6 m -58.12 -21.95 48.83 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.54 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 80.6 m-70 -115.16 -6.2 12.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.322 176.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.717 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 42.0 t -90.13 -46.39 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -66.05 93.99 0.22 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.771 0.32 . . . . 0.0 111.432 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -65.22 137.94 57.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.073 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 179.0 -67.98 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.295 174.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.462 ' HB2' ' HB3' ' A' ' 110' ' ' PRO . 13.0 tp10 -64.94 -29.81 70.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.013 0.911 . . . . 0.0 108.902 173.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.58 ' HA2' ' HG2' ' A' ' 108' ' ' GLN . . . -171.02 -178.09 41.33 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 114.065 -1.425 . . . . 0.0 109.555 174.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.49 ' HB3' ' O ' ' A' ' 145' ' ' LEU . 53.9 m -98.42 -42.53 7.3 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 117.377 0.589 . . . . 0.0 110.336 178.162 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -97.61 -28.21 14.03 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.568 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.58 ' HG2' ' HA2' ' A' ' 105' ' ' GLY . 20.6 pt20 -83.82 149.95 26.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.135 0.493 . . . . 0.0 111.406 -174.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.528 ' HA ' ' O ' ' A' ' 98' ' ' THR . . . -85.39 122.5 73.59 Favored Pre-proline 0 CA--C 1.512 -0.513 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.893 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.462 ' HB3' ' HB2' ' A' ' 104' ' ' GLU . 3.4 Cg_exo -80.78 72.56 6.46 Favored 'Trans proline' 0 N--CA 1.444 -1.42 0 C-N-CA 122.083 1.855 . . . . 0.0 111.795 173.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.425 HD23 ' HB1' ' A' ' 109' ' ' ALA . 2.8 mm? -62.23 80.44 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.921 0.867 . . . . 0.0 110.383 169.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 15.1 ptt? -98.94 -60.51 1.52 Allowed 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.668 -178.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.8 m -165.6 120.19 1.24 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.07 -35.29 66.8 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -172.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.2 -46.79 88.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.217 0.532 . . . . 0.0 110.544 179.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.03 -33.65 63.83 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.115 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.635 HD22 HG21 ' A' ' 98' ' ' THR . 17.0 tp -61.25 -39.01 88.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.998 175.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 51.3 mt -61.38 -44.01 97.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.129 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -68.27 -33.13 73.79 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.395 0.617 . . . . 0.0 110.331 176.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.48 -40.53 84.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.416 174.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.838 ' HA ' HG23 ' A' ' 97' ' ' ILE . 90.3 mt -61.79 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.146 177.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.762 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.7 t70 -58.7 -44.43 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.556 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.87 -33.89 50.59 Favored Glycine 0 C--N 1.332 0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.184 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.726 HG23 HD11 ' A' ' 97' ' ' ILE . 39.8 t -63.0 -53.84 41.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.582 0.23 . . . . 0.0 110.872 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.514 HD13 HD13 ' A' ' 93' ' ' LEU . 9.0 mp -63.95 -14.52 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.967 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.762 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.4 mtm180 -95.0 -50.14 5.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.251 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -117.7 -41.3 2.94 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -170.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.511 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -68.1 -18.79 64.75 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.523 0.678 . . . . 0.0 109.669 178.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.61 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 3.2 t70 -72.34 90.68 1.29 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.693 165.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -79.51 -16.85 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.276 -170.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -113.4 13.36 18.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -171.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.8 t30 53.8 50.11 17.67 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.27 173.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -110.9 -9.02 14.46 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.553 -0.459 . . . . 0.0 109.997 173.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 79.72 0.78 85.68 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.524 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.438 ' HB2' HD23 ' A' ' 87' ' ' LEU . 87.2 m-85 -126.08 175.35 7.81 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.499 HD11 ' CG1' ' A' ' 124' ' ' VAL . 10.2 tt -118.56 121.11 66.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.421 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -99.92 -176.87 3.37 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.308 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.841 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.2 t80 -53.41 -50.2 65.69 Favored 'General case' 0 C--O 1.225 -0.227 0 O-C-N 123.66 0.6 . . . . 0.0 111.812 -173.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.79 -35.14 78.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.768 0.318 . . . . 0.0 110.756 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.61 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 48.9 mt-10 -66.21 -53.79 32.94 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.815 -174.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.841 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -73.08 -32.03 64.74 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.798 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.61 97.73 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.124 0.487 . . . . 0.0 110.117 178.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -70.09 -29.03 65.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.927 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 9.6 t -82.45 -32.78 28.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.608 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.601 HD23 ' HG2' ' A' ' 73' ' ' GLN . 4.5 pp -84.04 12.85 5.69 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.205 0.526 . . . . 0.0 111.065 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.423 -0.799 . . . . 0.0 110.535 178.55 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.63 ' HB2' HD23 ' A' ' 72' ' ' LEU . 97.7 mmm . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 110.45 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.469 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 49.1 m -97.79 161.96 23.95 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.324 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.506 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.8 Cg_exo -50.83 -46.48 30.18 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.94 2.426 . . . . 0.0 114.57 -172.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -59.6 -49.23 78.55 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.509 ' HG3' ' HE2' ' A' ' 67' ' ' MET . 1.6 pm0 -78.35 -26.13 46.6 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 122.048 -0.407 . . . . 0.0 111.121 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.63 HD23 ' HB2' ' A' ' 67' ' ' MET . 11.8 mt -64.41 -20.02 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.524 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 29.6 mt-30 -73.35 -43.04 61.51 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 51.5 tp -65.61 -23.82 66.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.715 173.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.5 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 46.3 t60 -64.3 -37.29 86.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 176.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -69.26 -35.31 75.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.629 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.576 ' HD1' ' HE2' ' A' ' 141' ' ' PHE . 62.9 t80 -68.72 -50.33 51.67 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.514 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -80.05 -13.71 59.1 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.361 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.416 ' HE2' ' HA ' ' A' ' 79' ' ' MET . 0.6 OUTLIER -45.06 -41.29 7.49 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.94 0.775 . . . . 0.0 112.937 -172.035 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -141.49 10.52 2.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.904 -178.052 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.673 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 23.5 t70 -82.83 81.93 8.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.823 0.82 . . . . 0.0 109.681 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.56 15.62 18.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.723 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.0 p30 -99.69 -13.14 19.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.88 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 71.2 29.42 68.63 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.021 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -106.83 -3.58 20.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.477 0.638 . . . . 0.0 111.342 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 60.65 42.42 13.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.586 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.492 HD23 ' HB2' ' A' ' 135' ' ' TYR . 6.0 mt -158.3 153.56 25.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.419 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 77' ' ' PHE . 96.4 mt -106.15 113.34 26.82 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.912 0.387 . . . . 0.0 111.29 178.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.508 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 16.8 t70 -87.33 157.57 19.25 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.744 172.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -46.93 -35.74 8.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.671 -177.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.508 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 36.0 mt -65.42 -40.71 93.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.975 0.417 . . . . 0.0 111.656 -178.066 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.673 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 27.9 mt-10 -74.6 -44.22 51.79 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.549 1.166 . . . . 0.0 108.82 172.555 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.906 ' HG ' HG12 ' A' ' 97' ' ' ILE . 10.7 tp -63.77 -12.97 39.81 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 113.286 -1.779 . . . . 0.0 111.917 -169.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.857 ' HA ' HD11 ' A' ' 121' ' ' ILE . 40.9 p -51.82 -48.77 63.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.419 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -78.29 -26.94 47.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.205 0.526 . . . . 0.0 111.397 -176.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.54 ' HB1' HD11 ' A' ' 93' ' ' LEU . . . -80.98 -42.5 21.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.657 -173.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.906 HG12 ' HG ' ' A' ' 93' ' ' LEU . 45.1 mm -66.05 -17.41 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.043 0.449 . . . . 0.0 111.151 -177.303 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.575 HG21 HD22 ' A' ' 117' ' ' LEU . 2.0 m -63.69 -15.13 57.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 175.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -115.58 -32.98 5.37 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.449 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.778 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.3 t -59.86 -53.78 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.77 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 32.6 t-80 -73.65 74.53 1.52 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.001 0.429 . . . . 0.0 110.499 178.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.537 ' HB2' ' HA ' ' A' ' 106' ' ' SER . 23.2 pttm -71.65 145.83 48.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.98 176.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.692 ' HG3' ' H ' ' A' ' 104' ' ' GLU . 5.8 pt-20 -151.86 -78.4 0.12 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.842 174.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.692 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 11.5 pt-20 -87.06 14.26 7.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.596 0.713 . . . . 0.0 110.066 176.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.42 139.5 3.69 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.537 ' HA ' ' HB2' ' A' ' 102' ' ' LYS . 4.3 m -87.36 -41.35 13.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.484 0.659 . . . . 0.0 110.349 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.425 ' HG2' ' N ' ' A' ' 108' ' ' GLN . 0.4 OUTLIER -95.11 -27.08 15.75 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.021 -177.183 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.425 ' N ' ' HG2' ' A' ' 107' ' ' GLU . 49.1 mt-30 -76.21 141.6 41.74 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.043 -177.06 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.535 ' HB1' HG23 ' A' ' 98' ' ' THR . . . -88.58 118.41 69.36 Favored Pre-proline 0 CA--C 1.509 -0.625 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.818 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.415 ' O ' ' HG2' ' A' ' 112' ' ' MET . 7.4 Cg_exo -73.29 60.31 3.97 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.364 2.043 . . . . 0.0 111.68 177.058 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.66 77.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.114 0.959 . . . . 0.0 110.979 174.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.42 ' H ' ' HG2' ' A' ' 112' ' ' MET . 8.0 ptt? -95.44 -59.1 1.95 Allowed 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.718 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.3 m -160.59 118.58 2.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.505 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.0 pt-20 -52.54 -37.02 56.79 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -172.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -66.3 -42.05 88.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.979 0.418 . . . . 0.0 110.471 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -75.35 -29.06 59.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.315 178.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.575 HD22 HG21 ' A' ' 98' ' ' THR . 13.8 tp -65.0 -38.54 91.3 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 173.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 114' ' ' GLU . 90.6 mt -62.07 -43.1 97.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.249 172.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -63.43 -34.96 78.88 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.084 0.469 . . . . 0.0 110.407 175.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -39.56 85.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.38 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.857 HD11 ' HA ' ' A' ' 94' ' ' SER . 78.5 mt -66.27 -41.78 89.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.429 0.633 . . . . 0.0 109.865 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.802 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 29.6 t70 -62.33 -44.25 96.92 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.666 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.475 ' HA3' ' HD3' ' A' ' 126' ' ' ARG . . . -54.3 -34.37 53.86 Favored Glycine 0 C--N 1.334 0.46 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.998 176.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.818 HG22 HD11 ' A' ' 97' ' ' ILE . 39.0 t -59.07 -53.41 48.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.886 0.375 . . . . 0.0 110.196 172.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 62.7 mt -68.46 -0.77 5.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.618 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.802 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.9 mtp180 -103.43 -47.98 4.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.681 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -121.38 -38.23 2.81 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -173.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.526 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -75.77 -16.49 60.12 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.192 0.52 . . . . 0.0 110.805 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.598 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.5 t70 -78.9 87.24 4.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 169.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -74.88 -32.79 61.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.139 -168.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.98 -3.09 58.95 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.609 -176.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.598 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 18.7 m120 60.71 43.24 12.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.018 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.1 p30 -98.17 -12.58 21.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.358 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.68 4.29 89.05 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.335 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.492 ' HB2' HD23 ' A' ' 87' ' ' LEU . 59.2 m-85 -129.56 -179.85 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 175.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.489 HD12 ' HB3' ' A' ' 141' ' ' PHE . 8.9 tt -120.81 120.74 63.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.43 0.633 . . . . 0.0 110.142 174.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -97.22 -178.09 4.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.815 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 21.5 t80 -55.21 -49.04 72.97 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.413 0.446 . . . . 0.0 111.669 -172.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.64 -31.49 71.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.489 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.517 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.7 mt-10 -68.69 -51.26 43.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.404 -176.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.815 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.8 p90 -74.98 -32.48 61.69 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.734 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -61.08 -45.45 94.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.956 0.408 . . . . 0.0 110.074 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -65.62 -30.15 70.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.22 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 8.0 t -82.67 -37.01 25.43 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.831 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.436 HD11 HE21 ' A' ' 146' ' ' GLN . 3.8 pp -82.52 -27.04 31.96 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.206 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.436 HE21 HD11 ' A' ' 145' ' ' LEU . 19.9 mm-40 . . . . . 0 C--O 1.246 0.873 0 CA-C-O 118.354 -0.832 . . . . 0.0 110.461 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.601 ' HE3' ' HA ' ' A' ' 72' ' ' LEU . 51.8 mtp . . . . . 0 CA--C 1.52 -0.177 0 CA-C-O 121.057 0.455 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.472 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 3.9 m -91.44 152.91 44.11 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.738 177.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.58 -49.05 18.8 Favored 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.237 1.958 . . . . 0.0 113.698 -176.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.497 ' HA ' HE21 ' A' ' 73' ' ' GLN . 19.0 pt20 -60.42 -41.02 93.1 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.451 -175.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.472 ' HG2' ' O ' ' A' ' 68' ' ' SER . 12.9 pt-20 -75.74 -33.94 60.28 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.751 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.623 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -64.95 -21.68 66.87 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.329 0.585 . . . . 0.0 111.309 -174.532 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.497 HE21 ' HA ' ' A' ' 70' ' ' GLN . 46.6 mt-30 -73.09 -43.47 61.76 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 175.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.59 -20.86 66.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.911 172.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.623 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 39.0 t60 -64.65 -44.1 91.51 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 120.856 0.36 . . . . 0.0 110.348 175.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.727 ' CD1' HG21 ' A' ' 100' ' ' VAL . 3.8 m-30 -66.34 -25.97 67.07 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.24 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.738 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.6 t80 -74.17 -53.75 9.2 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.297 177.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.738 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.4 mmmt -80.63 -12.72 59.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.331 -173.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.485 ' HG2' ' HA ' ' A' ' 96' ' ' ALA . 1.0 OUTLIER -45.51 -35.69 4.03 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.981 0.801 . . . . 0.0 112.244 -174.149 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.79 10.58 1.06 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.554 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 30.1 t70 -84.55 81.71 8.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.909 0.861 . . . . 0.0 110.337 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -99.31 -6.88 27.16 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.286 177.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -95.8 -14.52 23.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.614 -174.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 66.37 23.96 72.01 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 114.911 0.724 . . . . 0.0 114.911 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -84.47 3.54 35.84 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.299 1.049 . . . . 0.0 111.026 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.617 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 29.2 m-80 59.52 28.0 17.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.531 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.0 mt -148.99 167.45 25.77 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.958 177.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 77' ' ' PHE . 13.0 mt -135.26 122.08 21.04 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.201 -179.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -103.67 -170.52 1.79 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -51.21 -38.67 40.85 Favored Glycine 0 CA--C 1.521 0.468 0 O-C-N 123.399 0.437 . . . . 0.0 113.978 -174.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.2 mt -67.75 -41.25 83.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.354 0.597 . . . . 0.0 111.09 -175.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.554 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 40.1 mt-10 -74.69 -45.79 42.05 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.624 0.726 . . . . 0.0 109.886 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.731 HD23 HG23 ' A' ' 136' ' ' ILE . 21.7 mt -63.92 -20.36 65.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.98 -1.009 . . . . 0.0 113.148 -172.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.759 ' HA ' HD11 ' A' ' 121' ' ' ILE . 53.4 p -53.53 -36.7 62.08 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.735 0.302 . . . . 0.0 111.624 -177.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -90.04 -33.4 16.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 0.0 111.141 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.577 ' O ' HG22 ' A' ' 100' ' ' VAL . . . -80.16 -47.47 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.738 -171.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.807 HD11 HG23 ' A' ' 124' ' ' VAL . 36.5 mm -59.44 -22.75 23.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.612 -174.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.772 HG21 HD23 ' A' ' 117' ' ' LEU . 18.5 m -58.88 -18.24 31.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.308 175.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -113.96 -17.27 12.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.403 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.727 HG21 ' CD1' ' A' ' 76' ' ' TYR . 2.4 t -88.27 -51.6 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.138 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.488 ' CD2' HG13 ' A' ' 120' ' ' ILE . 52.7 t60 -71.08 106.96 3.91 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.861 -177.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.447 ' HE2' ' O ' ' A' ' 144' ' ' SER . 67.6 mttm -60.6 141.21 56.94 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.094 179.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -162.64 -76.03 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.882 ' HB3' ' HB3' ' A' ' 110' ' ' PRO . 43.7 tt0 -99.89 -34.39 10.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.34 0.59 . . . . 0.0 109.623 173.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.419 ' H ' ' HG3' ' A' ' 110' ' ' PRO . . . -122.28 135.83 10.5 Favored Glycine 0 N--CA 1.441 -0.981 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.585 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.8 m -76.95 -44.92 29.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.073 0.463 . . . . 0.0 110.33 177.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -111.38 -32.13 6.82 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.977 178.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.412 ' O ' ' HD3' ' A' ' 110' ' ' PRO . 48.1 mt-30 -80.1 155.85 27.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.243 -176.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.85 111.52 24.14 Favored Pre-proline 0 CA--C 1.509 -0.624 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.496 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.882 ' HB3' ' HB3' ' A' ' 104' ' ' GLU . 2.8 Cg_endo -83.11 64.36 7.86 Favored 'Trans proline' 0 N--CA 1.439 -1.72 0 C-N-CA 122.03 1.82 . . . . 0.0 110.874 176.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 46.8 tp -63.08 81.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 122.002 0.906 . . . . 0.0 111.054 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.44 ' H ' ' HG2' ' A' ' 112' ' ' MET . 8.9 ptt? -89.62 -56.09 3.39 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.366 178.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.6 m -159.8 123.57 3.7 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 177.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.57 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.51 -40.86 65.74 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.742 -172.505 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.414 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 34.1 t70 -71.12 -39.88 71.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -67.48 -37.15 82.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.355 0.598 . . . . 0.0 109.597 174.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.772 HD23 HG21 ' A' ' 98' ' ' THR . 11.9 tp -61.86 -32.87 73.26 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.048 177.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.57 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.7 mt -62.78 -43.96 99.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.416 174.109 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . 0.498 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 16.6 m120 -69.02 -24.17 64.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.183 0.516 . . . . 0.0 110.607 176.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.488 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -66.07 -39.0 83.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.575 0.702 . . . . 0.0 109.505 173.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.763 ' HA ' HG23 ' A' ' 97' ' ' ILE . 80.1 mt -68.5 -38.76 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.379 174.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.602 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 94.4 m-20 -53.41 -49.55 67.04 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.732 172.041 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.81 -34.23 36.76 Favored Glycine 0 CA--C 1.508 -0.354 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.981 178.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.807 HG23 HD11 ' A' ' 97' ' ' ILE . 76.7 t -68.0 -51.78 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-O 120.801 0.334 . . . . 0.0 110.939 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.404 HD23 HD13 ' A' ' 93' ' ' LEU . 54.6 mt -67.72 -11.47 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.948 -177.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.602 ' NH1' ' HB3' ' A' ' 122' ' ' ASP . 48.8 mtt180 -105.64 -32.18 8.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.5 -177.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -132.18 -44.62 0.94 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -171.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.569 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 39.7 m-20 -71.62 -19.72 62.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.693 0.282 . . . . 0.0 111.468 -176.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.504 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -77.06 99.72 5.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 167.422 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -80.87 -19.08 45.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.904 -170.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 -3.65 29.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.549 -171.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 66.68 33.06 6.59 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.427 0.454 . . . . 0.0 111.376 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -97.08 -8.77 29.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.108 0.48 . . . . 0.0 110.056 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . 0.414 ' C ' ' HD2' ' A' ' 135' ' ' TYR . . . 79.97 -8.56 50.3 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.946 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.414 ' HD2' ' C ' ' A' ' 134' ' ' GLY . 5.3 m-30 -115.58 167.09 11.21 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.731 HG23 HD23 ' A' ' 93' ' ' LEU . 8.1 tt -111.76 118.2 57.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.792 0.806 . . . . 0.0 110.436 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -88.13 168.84 12.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.067 177.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.811 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.0 t80 -50.43 -47.67 56.57 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 123.084 0.24 . . . . 0.0 110.406 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.16 75.15 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 120.757 0.313 . . . . 0.0 111.379 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.504 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 45.3 mt-10 -68.68 -54.86 13.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.444 -176.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.811 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -70.72 -30.54 67.1 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.49 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.662 ' O ' ' HG2' ' A' ' 146' ' ' GLN . . . -61.69 -50.23 73.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 176.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -63.82 -32.39 73.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.099 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.447 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 15.9 t -77.7 -28.59 51.05 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.385 -177.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.495 HD23 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp -89.59 -5.24 57.36 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.412 -0.18 . . . . 0.0 111.107 -179.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.662 ' HG2' ' O ' ' A' ' 142' ' ' ALA . 28.6 mm-40 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.694 -0.669 . . . . 0.0 110.324 177.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.685 ' HB2' HD22 ' A' ' 72' ' ' LEU . 89.6 mmm . . . . . 0 N--CA 1.461 0.115 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.494 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -88.43 153.09 50.59 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.297 0.094 . . . . 0.0 111.196 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.89 -44.02 43.94 Favored 'Trans proline' 0 N--CA 1.476 0.492 0 C-N-CA 123.307 2.671 . . . . 0.0 114.701 -170.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -59.48 -49.06 79.23 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.741 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -74.5 -26.27 59.9 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.586 175.937 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.685 HD22 ' HB2' ' A' ' 67' ' ' MET . 17.2 mt -63.34 -18.89 64.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.401 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 17.6 mt-30 -71.71 -45.43 61.85 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.43 -21.02 66.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.566 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.57 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 7.9 t60 -66.9 -40.31 87.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.106 177.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.603 ' HE2' ' CD2' ' A' ' 145' ' ' LEU . 5.9 m-30 -68.39 -32.99 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.539 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 57.3 t80 -71.02 -51.17 26.94 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.296 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -80.56 -16.91 53.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.868 -175.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.551 ' HE1' ' CE1' ' A' ' 75' ' ' HIS . 13.0 tpp -44.35 -48.69 9.72 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.646 0.591 . . . . 0.0 112.404 -172.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.728 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -130.68 10.22 5.11 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.88 -175.584 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.715 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 26.5 t70 -80.47 75.15 7.33 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.68 0.752 . . . . 0.0 110.005 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -91.53 -15.27 28.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.122 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.6 p30 -76.41 -14.24 60.08 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 -177.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.82 30.57 77.49 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.483 -0.78 . . . . 0.0 113.065 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -101.36 3.45 40.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 117.294 0.547 . . . . 0.0 111.229 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 64.15 34.51 10.98 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.335 0.588 . . . . 0.0 110.479 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.496 ' HB3' ' CD2' ' A' ' 135' ' ' TYR . 15.6 mt -157.23 158.33 35.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.88 178.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.494 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 88.3 mt -120.15 121.43 38.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.82 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.46 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 0.6 OUTLIER -92.24 -177.45 4.66 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.399 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -55.85 -37.09 68.36 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.295 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.46 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 26.0 mt -68.66 -47.75 65.73 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.141 0.496 . . . . 0.0 110.368 -177.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.728 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 45.2 mt-10 -64.11 -42.23 96.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.87 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.749 HD23 HG23 ' A' ' 136' ' ' ILE . 24.1 mt -66.55 -18.39 65.34 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.792 -175.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.623 ' HA ' ' CD1' ' A' ' 121' ' ' ILE . 46.4 t -57.1 -32.06 65.91 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.689 0.28 . . . . 0.0 111.048 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.88 -31.01 15.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.069 0.461 . . . . 0.0 111.188 178.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.57 -43.73 12.46 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.823 HG23 ' HA ' ' A' ' 121' ' ' ILE . 39.7 mm -64.77 -25.91 38.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -175.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.679 HG23 ' HB1' ' A' ' 109' ' ' ALA . 17.9 m -58.47 -20.27 43.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.724 174.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.494 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 68.3 m-70 -109.44 -27.07 9.66 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 173.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.759 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 38.4 t -67.48 -58.66 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.719 0.295 . . . . 0.0 111.173 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -82.21 70.52 9.16 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.364 0.602 . . . . 0.0 110.026 -177.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.633 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -66.48 135.23 53.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.569 179.458 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.45 ' H ' ' HG3' ' A' ' 110' ' ' PRO . 20.9 mm-40 -113.91 -49.79 2.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.322 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -91.74 -20.97 20.98 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -175.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -148.2 -142.2 3.61 Favored Glycine 0 CA--C 1.507 -0.461 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.567 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.2 t -123.05 -53.98 1.83 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 117.106 0.453 . . . . 0.0 110.437 178.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.11 -38.76 16.18 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-O 121.346 0.594 . . . . 0.0 110.113 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -64.54 130.03 42.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.518 -173.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.679 ' HB1' HG23 ' A' ' 98' ' ' THR . . . -73.88 121.44 85.19 Favored Pre-proline 0 CA--C 1.505 -0.762 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.703 174.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.45 ' HG3' ' H ' ' A' ' 103' ' ' GLU . 3.7 Cg_exo -78.19 65.99 8.37 Favored 'Trans proline' 0 N--CA 1.443 -1.486 0 C-N-CA 121.745 1.63 . . . . 0.0 111.228 177.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.62 81.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.864 0.84 . . . . 0.0 111.095 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.433 ' CG ' ' H ' ' A' ' 113' ' ' SER . 14.4 ptt? -98.23 -57.81 2.12 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.005 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.433 ' H ' ' CG ' ' A' ' 112' ' ' MET . 73.6 m -162.39 124.58 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.512 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.25 -37.88 65.18 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.132 -173.939 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.78 -43.93 82.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.026 0.441 . . . . 0.0 110.662 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.08 -39.73 86.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.344 0.592 . . . . 0.0 109.932 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.61 HD12 HG21 ' A' ' 98' ' ' THR . 10.8 mt -62.66 -37.67 87.33 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.99 175.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 114' ' ' GLU . 63.6 mt -60.82 -42.98 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.032 0.444 . . . . 0.0 110.619 172.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -67.36 -29.81 69.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.222 0.534 . . . . 0.0 110.479 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.407 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.0 OUTLIER -65.57 -34.49 70.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.885 174.656 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.823 ' HA ' HG23 ' A' ' 97' ' ' ILE . 88.4 mt -67.26 -38.34 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.8 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.809 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.9 t70 -60.79 -46.0 92.21 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.232 176.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.56 -37.75 41.91 Favored Glycine 0 C--N 1.334 0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.007 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.767 HG23 HD11 ' A' ' 97' ' ' ILE . 54.8 t -63.58 -51.04 75.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 110.417 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.8 mt -65.02 -7.48 12.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.45 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.809 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 13.6 mtm180 -106.42 -49.33 3.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.847 0.356 . . . . 0.0 110.791 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -113.13 -44.19 3.29 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -169.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.495 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 27.3 m-20 -71.8 -23.89 61.64 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.151 0.5 . . . . 0.0 110.028 -177.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.578 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 4.6 t70 -76.05 88.22 2.98 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 168.006 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . 0.518 ' HB3' ' HZ3' ' A' ' 130' ' ' LYS . 0.2 OUTLIER -75.5 -21.51 57.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.477 -169.555 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -108.14 6.46 26.85 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.168 -170.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.444 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 44.1 m-80 58.41 38.96 25.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 175.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.9 p30 -96.74 -13.27 22.8 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.308 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.18 2.69 90.45 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.312 178.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.496 ' CD2' ' HB3' ' A' ' 87' ' ' LEU . 28.5 m-85 -124.7 173.43 8.55 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.749 HG23 HD23 ' A' ' 93' ' ' LEU . 6.7 tt -116.18 123.41 71.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.423 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.5 p30 -101.03 -179.69 4.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.833 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 4.3 t80 -53.65 -50.31 66.05 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 123.558 0.537 . . . . 0.0 111.209 -174.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.63 -20.43 64.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.68 -176.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.578 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -80.12 -52.92 7.19 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 -176.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.833 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -70.14 -33.31 71.63 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.274 178.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.37 -41.23 93.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.845 0.355 . . . . 0.0 110.732 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.7 mtmm -70.69 -28.44 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.931 176.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.421 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 14.9 t -80.87 -17.33 51.03 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -175.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.746 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 85.8 mt -89.45 0.54 56.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.419 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.063 178.685 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.698 ' HE1' ' HG3' ' A' ' 71' ' ' GLU . 94.0 mmm . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.17 158.38 39.33 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-O 119.635 -0.221 . . . . 0.0 110.48 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.591 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 9.6 Cg_endo -52.34 -43.34 54.64 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.904 2.403 . . . . 0.0 113.618 -173.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -54.03 51.38 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.933 -175.129 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.698 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 6.8 pm0 -72.36 -28.76 63.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.679 177.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.762 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 25.7 mt -63.87 -19.7 65.27 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.965 0.412 . . . . 0.0 110.938 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.795 ' HG2' HD23 ' A' ' 145' ' ' LEU . 17.8 mt-30 -66.15 -39.32 89.72 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 174.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.512 ' HG ' ' HG2' ' A' ' 78' ' ' LYS . 30.8 tp -77.22 -19.17 57.03 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.835 173.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.762 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 19.7 t60 -73.32 -38.67 65.74 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.668 ' CD2' HG21 ' A' ' 100' ' ' VAL . 6.9 m-30 -68.14 -41.61 81.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.035 175.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.644 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 50.0 t80 -66.37 -52.64 44.7 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.522 -175.551 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.644 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.6 mmmt -77.71 -15.77 58.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.989 -175.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.4 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 35.4 tpp -45.39 -44.87 12.28 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 123.84 0.712 . . . . 0.0 111.883 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.577 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -132.48 7.68 4.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.404 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.481 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 24.0 t70 -92.75 85.35 5.19 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.832 0.825 . . . . 0.0 109.487 178.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.528 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 23.0 m-85 -96.64 -8.89 30.48 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.209 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -88.63 -16.37 32.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.732 -175.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.72 28.17 65.13 Favored Glycine 0 CA--C 1.524 0.637 0 CA-C-N 115.886 -0.597 . . . . 0.0 113.764 176.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.439 ' O ' ' HB3' ' A' ' 86' ' ' ASN . 18.9 p-10 -95.44 18.1 13.31 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 117.412 0.606 . . . . 0.0 111.5 -174.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.439 ' HB3' ' O ' ' A' ' 85' ' ' ASN . 4.3 t-20 76.48 -27.09 0.18 Allowed 'General case' 0 N--CA 1.47 0.557 0 O-C-N 123.782 0.676 . . . . 0.0 112.046 175.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.523 HD11 ' HB2' ' A' ' 135' ' ' TYR . 2.6 mm? -112.81 162.63 15.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.105 0.955 . . . . 0.0 112.459 -176.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.477 ' CB ' HD12 ' A' ' 93' ' ' LEU . 1.3 mt -132.26 123.38 26.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.612 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.427 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.0 p-10 -96.25 175.44 6.44 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.41 -37.32 12.14 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 114.108 0.403 . . . . 0.0 114.108 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.427 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 54.6 mt -65.13 -52.52 54.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.468 0.634 . . . . 0.0 110.707 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.577 ' HA ' ' HD1' ' A' ' 80' ' ' HIS . 43.9 mt-10 -61.47 -54.67 40.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.307 1.051 . . . . 0.0 109.33 174.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.97 ' HG ' HG12 ' A' ' 97' ' ' ILE . 5.5 tp -66.45 -9.82 37.99 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.836 -1.529 . . . . 0.0 112.917 -166.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.999 ' HA ' HD11 ' A' ' 121' ' ' ILE . 58.8 p -56.13 -45.32 79.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 111.343 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -23.53 51.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.218 0.532 . . . . 0.0 111.188 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.577 ' O ' HG22 ' A' ' 100' ' ' VAL . . . -86.42 -58.38 2.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.37 -175.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.97 HG12 ' HG ' ' A' ' 93' ' ' LEU . 24.4 mm -61.85 -20.36 23.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.281 -172.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.733 HG21 HD22 ' A' ' 117' ' ' LEU . 99.3 m -53.33 -31.52 44.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.081 0.467 . . . . 0.0 110.832 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 57.3 m-70 -94.82 -37.16 11.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.112 0.482 . . . . 0.0 110.823 176.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.933 HG23 ' HE1' ' A' ' 141' ' ' PHE . 2.1 t -72.57 -50.93 31.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.033 -170.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.566 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.7 t60 -78.6 69.76 4.84 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.428 ' HD3' ' O ' ' A' ' 106' ' ' SER . 35.4 pttt -64.7 86.29 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.012 -0.995 . . . . 0.0 111.893 -177.429 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.459 ' HG3' ' HG3' ' A' ' 104' ' ' GLU . 13.1 tp10 -67.36 -61.0 2.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.242 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.459 ' HG3' ' HG3' ' A' ' 103' ' ' GLU . 41.1 mt-10 -124.74 56.29 1.31 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.083 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -171.35 -166.16 29.72 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.428 ' O ' ' HD3' ' A' ' 102' ' ' LYS . 9.7 t -126.68 -91.78 0.51 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.885 0.343 . . . . 0.0 110.252 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -93.26 -27.95 16.53 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 121.858 0.837 . . . . 0.0 109.554 -178.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.18 163.46 17.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.565 -178.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.494 ' HB2' HG23 ' A' ' 98' ' ' THR . . . -78.08 117.94 69.12 Favored Pre-proline 0 CA--C 1.506 -0.737 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.012 -174.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.544 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.1 Cg_endo -77.78 67.37 7.97 Favored 'Trans proline' 0 N--CA 1.445 -1.373 0 C-N-CA 121.422 1.415 . . . . 0.0 111.492 174.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.55 80.69 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.886 0.85 . . . . 0.0 111.33 173.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 12.2 ptt? -86.59 -56.81 3.25 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.244 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.0 m -163.7 126.36 2.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.427 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -51.15 -38.91 54.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.554 -174.052 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.3 -50.44 65.68 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.048 0.451 . . . . 0.0 111.068 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -64.61 -35.05 79.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.524 0.678 . . . . 0.0 109.946 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.733 HD22 HG21 ' A' ' 98' ' ' THR . 15.7 tp -65.09 -41.62 94.82 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.368 178.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 114' ' ' GLU . 55.0 mt -61.56 -42.1 92.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.581 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . 0.423 ' O ' ' HB3' ' A' ' 122' ' ' ASP . 91.8 m-20 -71.62 -23.92 61.79 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.218 0.533 . . . . 0.0 110.71 176.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.566 HG13 ' CD2' ' A' ' 101' ' ' HIS . 0.9 OUTLIER -68.31 -33.66 61.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.303 0.573 . . . . 0.0 109.935 174.065 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.999 HD11 ' HA ' ' A' ' 94' ' ' SER . 58.8 mt -75.16 -17.69 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 121.636 0.731 . . . . 0.0 109.861 174.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.669 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 19.9 t70 -75.44 -36.76 60.69 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.37 -37.27 80.65 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.671 -1.15 . . . . 0.0 113.148 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.634 HG13 ' O ' ' A' ' 121' ' ' ILE . 7.2 p -60.46 -43.34 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 CA-C-N 117.555 0.677 . . . . 0.0 109.97 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.24 -13.82 62.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.082 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.669 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 28.6 mtm-85 -99.22 -50.1 4.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.563 -178.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -119.07 -20.98 7.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -168.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.562 ' CG ' ' HG ' ' A' ' 144' ' ' SER . 41.5 m-20 -89.89 -27.89 19.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.423 178.491 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.487 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -77.68 94.41 4.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.639 0.733 . . . . 0.0 109.316 172.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -80.42 -32.38 37.4 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.217 -0.902 . . . . 0.0 111.462 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.1 -0.18 56.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.676 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.487 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 73.5 m-20 63.88 28.08 14.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.7 176.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.8 p30 -84.06 -13.58 52.73 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.993 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 86.26 1.36 86.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.561 176.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.523 ' HB2' HD11 ' A' ' 87' ' ' LEU . 33.4 m-85 -130.54 176.41 8.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.45 HD12 ' CD1' ' A' ' 141' ' ' PHE . 6.3 tt -111.01 123.57 67.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.269 174.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.97 167.79 11.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.963 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -51.9 -41.2 61.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.605 0.184 . . . . 0.0 111.397 -178.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.78 -44.58 92.96 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.733 0.301 . . . . 0.0 110.693 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.429 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 46.5 mt-10 -67.13 -41.47 86.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.933 ' HE1' HG23 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -59.99 -54.77 42.12 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.496 178.013 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . 0.623 ' O ' ' HG2' ' A' ' 146' ' ' GLN . . . -57.34 -47.04 82.61 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.875 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -65.38 -34.52 78.5 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.854 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.562 ' HG ' ' CG ' ' A' ' 128' ' ' ASP . 36.8 t -75.36 -29.75 59.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.939 0.4 . . . . 0.0 110.65 -177.367 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.795 HD23 ' HG2' ' A' ' 73' ' ' GLN . 3.9 pp -86.77 -3.4 59.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.339 -178.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.623 ' HG2' ' O ' ' A' ' 142' ' ' ALA . 29.8 mm-40 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.394 177.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.68 ' HE1' ' HG2' ' A' ' 71' ' ' GLU . 97.3 mmm . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 120.949 0.404 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.5 m -81.59 155.1 71.32 Favored Pre-proline 0 C--O 1.223 -0.329 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.656 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.4 Cg_exo -53.97 -51.39 10.81 Favored 'Trans proline' 0 N--CA 1.477 0.52 0 C-N-CA 122.659 2.239 . . . . 0.0 114.609 -173.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -67.2 -35.85 80.48 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.34 0.59 . . . . 0.0 110.358 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.68 ' HG2' ' HE1' ' A' ' 67' ' ' MET . 5.5 tp10 -58.04 -53.3 59.85 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.928 173.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.62 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 24.3 mt -58.07 -23.26 53.93 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 113.808 -1.542 . . . . 0.0 112.933 -175.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 13.7 mt-30 -70.93 -41.74 70.79 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 175.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.56 -25.53 66.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.141 171.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.62 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 11.3 t60 -64.38 -40.68 96.29 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.08 174.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.487 ' OH ' ' HB3' ' A' ' 99' ' ' HIS . 3.6 m-30 -67.93 -30.72 70.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.235 0.54 . . . . 0.0 109.995 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.665 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.4 t80 -69.43 -51.83 32.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.762 177.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.665 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.4 mmmt -79.36 -12.51 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.412 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.4 tpt -44.88 -36.83 3.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.989 0.915 . . . . 0.0 112.688 -172.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.502 ' HD1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -147.57 10.23 0.95 Allowed 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.867 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.717 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 28.6 t70 -86.38 88.22 7.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.319 0.58 . . . . 0.0 110.396 -178.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.498 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 29.0 m-85 -112.02 -0.92 15.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.944 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -85.12 -13.82 49.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.043 -171.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.69 13.95 81.71 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.167 -0.54 . . . . 0.0 113.363 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -92.97 -5.29 51.02 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.712 0.756 . . . . 0.0 110.781 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 62.47 20.01 11.6 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.596 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.48 HD11 ' HB2' ' A' ' 135' ' ' TYR . 1.3 mm? -132.32 153.18 50.98 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.212 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.522 ' HB2' HG23 ' A' ' 136' ' ' ILE . 3.9 mm? -106.59 114.53 28.69 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.173 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.499 ' OD2' ' HG3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -93.77 -178.91 4.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.3 178.819 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.09 -51.04 48.91 Favored Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 114.309 0.484 . . . . 0.0 114.309 -176.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.598 HD11 ' N ' ' A' ' 92' ' ' GLU . 4.4 pp -73.8 -28.45 61.65 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.115 0.457 . . . . 0.0 110.875 -174.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.717 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 50.4 mt-10 -66.68 -52.15 48.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.037 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.838 ' HB3' HG12 ' A' ' 97' ' ' ILE . 30.3 mt -66.71 -7.38 20.53 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.393 -177.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.751 ' HA ' HD12 ' A' ' 121' ' ' ILE . 75.4 m -56.84 -31.77 65.09 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.109 176.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -91.61 -32.17 15.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.074 0.464 . . . . 0.0 111.15 175.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -84.29 -41.7 16.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.226 -169.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.874 ' HB ' HG12 ' A' ' 121' ' ' ILE . 40.2 mm -68.05 -17.85 22.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -177.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.795 HG21 HD11 ' A' ' 117' ' ' LEU . 4.7 m -60.01 -25.91 65.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.166 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.487 ' HB3' ' OH ' ' A' ' 76' ' ' TYR . 62.2 m-70 -103.5 -33.56 9.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.663 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.812 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 32.6 t -58.59 -51.41 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 177.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -70.61 85.62 0.64 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 167.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -81.11 161.2 24.22 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 174.93 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -151.57 -84.9 0.08 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.963 -177.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -75.65 -25.9 57.24 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.446 0.641 . . . . 0.0 110.012 178.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . 0.651 ' HA2' ' HG2' ' A' ' 108' ' ' GLN . . . -129.94 172.35 20.14 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 172.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.42 ' HA ' ' HB2' ' A' ' 102' ' ' LYS . 11.2 m -100.37 -46.89 5.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 117.694 0.747 . . . . 0.0 110.341 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.412 ' H ' ' CD ' ' A' ' 107' ' ' GLU . 0.8 OUTLIER -88.15 -31.54 19.1 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.443 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.651 ' HG2' ' HA2' ' A' ' 105' ' ' GLY . 20.0 pt20 -77.82 138.11 38.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.11 0.481 . . . . 0.0 110.775 -178.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.584 ' HB2' HG23 ' A' ' 98' ' ' THR . . . -77.3 124.17 87.01 Favored Pre-proline 0 CA--C 1.507 -0.689 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.198 176.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.481 ' HD2' ' O ' ' A' ' 98' ' ' THR . 53.4 Cg_endo -79.65 65.67 8.86 Favored 'Trans proline' 0 N--CA 1.441 -1.56 0 C-N-CA 121.552 1.501 . . . . 0.0 111.323 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -49.84 94.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.505 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -106.94 -47.78 3.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.064 -179.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.4 m 179.99 117.96 0.05 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -177.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.541 ' O ' HG13 ' A' ' 118' ' ' ILE . 16.3 pt-20 -56.76 -36.69 70.1 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.794 -175.112 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -66.78 -45.63 77.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.833 0.349 . . . . 0.0 110.182 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.09 -44.32 96.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.644 0.735 . . . . 0.0 109.888 177.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.795 HD11 HG21 ' A' ' 98' ' ' THR . 11.7 mt -60.23 -37.7 81.13 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.699 -1.137 . . . . 0.0 111.521 176.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.683 ' HA ' HD11 ' A' ' 121' ' ' ILE . 61.8 mt -61.07 -37.34 77.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.839 0.352 . . . . 0.0 110.91 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -65.38 -38.14 89.14 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.477 0.656 . . . . 0.0 109.266 174.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.2 mp -61.57 -42.16 92.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.765 174.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.874 HG12 ' HB ' ' A' ' 97' ' ' ILE . 93.3 mt -60.52 -36.93 73.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.603 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.823 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 33.9 t70 -61.31 -43.64 98.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.59 -29.04 60.52 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.718 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.689 HG23 HD11 ' A' ' 97' ' ' ILE . 79.1 t -65.01 -53.81 36.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.494 0.187 . . . . 0.0 110.759 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 67.4 mt -65.65 -14.11 60.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.37 -175.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.823 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 15.9 mtp85 -103.66 -36.0 8.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.105 -177.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -124.08 -47.08 1.92 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -170.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.554 ' HB3' HG12 ' A' ' 124' ' ' VAL . 12.6 t70 -71.91 -19.29 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.77 0.795 . . . . 0.0 109.809 -178.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.54 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 1.6 t70 -72.56 90.85 1.37 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.689 166.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -79.19 -27.9 42.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.214 -170.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -88.26 -3.66 58.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.76 -176.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.54 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 14.1 t30 61.65 49.48 4.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.586 0.708 . . . . 0.0 110.727 179.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 52.8 p30 -107.62 -8.29 16.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.516 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.37 1.31 90.41 Favored Glycine 0 C--N 1.329 0.183 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.055 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.48 ' HB2' HD11 ' A' ' 87' ' ' LEU . 50.4 m-85 -131.21 178.02 7.02 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 174.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.543 HG23 HD12 ' A' ' 93' ' ' LEU . 6.1 tt -114.97 126.21 72.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.217 0.532 . . . . 0.0 109.607 175.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -102.78 -178.22 3.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.704 175.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.832 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 44.1 t80 -56.75 -46.91 81.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 123.341 0.4 . . . . 0.0 111.598 -172.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.2 -28.27 67.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.646 0.26 . . . . 0.0 111.344 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.46 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.5 mt-10 -72.74 -56.37 5.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.231 -175.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.832 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.9 p90 -70.6 -27.72 64.3 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.159 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.52 -34.24 77.76 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.337 179.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 47.4 mtmt -76.7 -32.61 57.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.374 177.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.555 ' OG ' ' HA ' ' A' ' 141' ' ' PHE . 1.3 p -82.27 -30.36 30.68 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.572 -174.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.5 pp -78.37 0.79 24.23 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.512 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.198 175.15 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.573 ' HB2' HD22 ' A' ' 72' ' ' LEU . 92.3 mmm . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.482 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 6.3 m -76.4 160.7 77.0 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -178.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.482 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 9.9 Cg_endo -52.79 -43.69 53.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.928 2.418 . . . . 0.0 112.693 -178.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.428 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 6.9 pt20 -56.98 -48.37 78.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.531 178.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.445 ' HG3' ' HE1' ' A' ' 67' ' ' MET . 3.8 mm-40 -59.61 -52.97 63.26 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.502 175.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.573 HD22 ' HB2' ' A' ' 67' ' ' MET . 24.3 mt -60.38 -21.68 62.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.184 -166.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLN . . . . . 0.548 ' HG2' HD22 ' A' ' 145' ' ' LEU . 76.8 mt-30 -70.34 -46.2 64.62 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 174.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.9 tp -66.15 -22.36 66.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.831 172.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.553 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.1 t60 -66.98 -42.97 84.19 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.709 ' CD2' HG23 ' A' ' 100' ' ' VAL . 4.3 m-30 -70.32 -31.47 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 178.03 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.612 ' HD1' ' HE1' ' A' ' 141' ' ' PHE . 57.6 t80 -67.59 -53.28 29.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -80.62 -13.85 58.69 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.581 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.452 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.6 tpt -44.23 -40.0 4.84 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.752 0.821 . . . . 0.0 112.401 -170.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.652 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -146.49 10.41 1.09 Allowed 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.944 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.611 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.4 t70 -84.63 85.15 7.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.408 0.623 . . . . 0.0 109.764 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' TYR . . . . . 0.652 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 69.5 m-85 -104.14 -6.66 20.84 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.511 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 p30 -77.76 -13.86 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.203 0.525 . . . . 0.0 110.943 -178.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 67.34 26.86 73.47 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.554 -0.748 . . . . 0.0 113.161 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -99.98 -2.87 33.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 117.464 0.632 . . . . 0.0 110.462 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 63.12 31.89 15.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.349 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.519 HD23 ' HB2' ' A' ' 135' ' ' TYR . 15.8 mt -141.89 141.09 33.02 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.529 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.621 ' HB2' HG23 ' A' ' 136' ' ' ILE . 4.0 mm? -95.36 109.25 21.44 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -83.95 161.88 20.64 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.784 175.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.96 -48.5 24.85 Favored Glycine 0 C--O 1.23 -0.15 0 CA-C-O 119.782 -0.455 . . . . 0.0 113.842 -178.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.694 HD11 ' N ' ' A' ' 92' ' ' GLU . 4.1 pp -68.48 -32.27 72.15 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 117.409 0.604 . . . . 0.0 111.592 -175.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.694 ' N ' HD11 ' A' ' 91' ' ' LEU . 50.4 mt-10 -71.25 -58.78 3.22 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.555 1.169 . . . . 0.0 108.272 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 1.106 ' HG ' HG12 ' A' ' 97' ' ' ILE . 12.3 tp -60.84 -11.5 7.96 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 112.897 -1.956 . . . . 0.0 111.466 -174.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.81 ' HA ' HD11 ' A' ' 121' ' ' ILE . 7.9 m -52.72 -32.28 42.13 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.448 0.699 . . . . 0.0 112.71 178.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.0 -35.2 15.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.958 178.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.594 ' O ' HG21 ' A' ' 100' ' ' VAL . . . -75.36 -41.3 56.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.276 -170.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 1.106 HG12 ' HG ' ' A' ' 93' ' ' LEU . 26.8 mm -60.07 -19.89 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -174.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.641 HG21 HD22 ' A' ' 117' ' ' LEU . 4.4 m -55.25 -27.94 49.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.35 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.475 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 58.6 m-70 -107.93 -18.08 13.89 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.929 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.709 HG23 ' CD2' ' A' ' 76' ' ' TYR . 2.3 t -84.99 -53.52 10.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.531 -174.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . 0.674 ' CD2' ' HB2' ' A' ' 103' ' ' GLU . 21.2 t60 -66.98 98.31 0.55 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 178.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.502 ' HB2' ' HA ' ' A' ' 106' ' ' SER . 22.1 pttm -75.43 77.93 2.49 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.662 0.744 . . . . 0.0 111.774 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.674 ' HB2' ' CD2' ' A' ' 101' ' ' HIS . 10.3 tp10 -88.47 -48.09 7.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.342 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -96.2 -68.65 0.79 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.918 -178.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -97.67 -153.71 29.18 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 170.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.502 ' HA ' ' HB2' ' A' ' 102' ' ' LYS . 49.4 m -106.02 -83.15 0.52 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.517 0.659 . . . . 0.0 110.154 174.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -76.15 -6.99 53.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.284 0.564 . . . . 0.0 110.689 173.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.462 ' O ' ' HD3' ' A' ' 110' ' ' PRO . 16.9 mt-30 -71.46 137.78 48.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.566 179.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.542 ' HA ' ' O ' ' A' ' 98' ' ' THR . . . -83.31 111.85 34.41 Favored Pre-proline 0 CA--C 1.511 -0.521 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.572 173.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' PRO . . . . . 0.462 ' HD3' ' O ' ' A' ' 108' ' ' GLN . 2.3 Cg_endo -80.81 69.64 7.87 Favored 'Trans proline' 0 N--CA 1.441 -1.589 0 C-N-CA 121.795 1.663 . . . . 0.0 111.197 174.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.9 75.34 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.015 0.912 . . . . 0.0 110.734 171.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.401 ' CG ' ' H ' ' A' ' 113' ' ' SER . 12.8 ptt? -95.26 -58.01 2.25 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.04 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.401 ' H ' ' CG ' ' A' ' 112' ' ' MET . 13.7 m -160.99 127.24 3.93 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 176.2 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.59 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.72 -38.38 64.26 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.805 -178.011 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.494 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 20.7 t70 -64.8 -46.22 82.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.27 0.557 . . . . 0.0 110.861 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.57 -38.66 91.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.291 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.641 HD22 HG21 ' A' ' 98' ' ' THR . 6.7 tp -63.85 -32.12 73.53 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.309 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . 0.59 HG13 ' O ' ' A' ' 114' ' ' GLU . 73.9 mt -59.36 -45.48 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.129 174.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -64.29 -38.17 90.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.3 0.572 . . . . 0.0 110.039 175.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.516 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.3 mp -58.51 -46.67 89.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.068 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.81 HD11 ' HA ' ' A' ' 94' ' ' SER . 71.4 mt -62.9 -45.49 98.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 0.0 110.39 177.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . 0.521 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.6 t70 -57.77 -44.94 86.51 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.12 52.52 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.691 177.516 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.791 HG22 HD11 ' A' ' 97' ' ' ILE . 46.2 t -65.3 -54.77 25.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.805 174.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.92 -7.25 26.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.193 0.52 . . . . 0.0 111.441 -176.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 9.9 mtt180 -107.74 -36.04 6.52 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.834 -178.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -127.12 -41.79 1.75 Allowed 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.538 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 1.3 m-20 -71.73 -18.47 62.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.497 0.665 . . . . 0.0 110.22 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.562 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 2.2 t70 -77.81 93.12 4.29 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 165.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -79.09 -21.46 46.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.039 -169.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.63 -4.54 53.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -176.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ASN . . . . . 0.43 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 20.3 m120 61.25 34.78 18.52 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.379 -177.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -93.42 -15.16 25.93 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.767 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.3 -2.89 75.34 Favored Glycine 0 N--CA 1.453 -0.17 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.965 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' TYR . . . . . 0.519 ' HB2' HD23 ' A' ' 87' ' ' LEU . 45.5 m-85 -129.35 164.86 22.67 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 120.971 0.415 . . . . 0.0 110.005 178.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.621 HG23 ' HB2' ' A' ' 88' ' ' LEU . 6.4 tt -106.34 126.59 62.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.509 175.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.575 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 0.2 OUTLIER -103.23 178.96 4.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.304 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' TYR . . . . . 0.809 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.9 t80 -53.02 -48.02 67.88 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.363 0.414 . . . . 0.0 111.264 -176.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.65 -30.02 69.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.963 0.411 . . . . 0.0 111.491 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . 0.575 ' HG3' ' OD1' ' A' ' 137' ' ' ASP . 52.1 mt-10 -73.92 -50.79 18.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.251 -177.149 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' PHE . . . . . 0.809 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -74.7 -25.49 59.18 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.596 178.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.97 -43.03 91.31 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.129 0.49 . . . . 0.0 110.102 175.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.441 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 34.5 mtmm -74.72 -28.44 60.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.745 176.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' SER . . . . . 0.474 ' O ' ' HG2' ' A' ' 102' ' ' LYS . 23.2 t -78.55 -43.04 27.64 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.065 -171.326 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.572 HD11 HE21 ' A' ' 146' ' ' GLN . 2.8 pp -84.24 -7.4 59.35 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.943 0.401 . . . . 0.0 111.387 -175.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.572 HE21 HD11 ' A' ' 145' ' ' LEU . 23.8 mm-40 . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.833 -178.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.622 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.3 mmm . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.655 0.264 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.647 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 41.0 t -88.01 147.82 41.7 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.175 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.66 -44.11 37.1 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.002 2.468 . . . . 0.0 114.125 -174.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.548 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 7.3 pt20 -56.81 -52.91 63.21 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.676 -177.198 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.647 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.1 pt-20 -73.1 -26.45 61.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.493 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.622 HD21 ' HB2' ' A' ' 67' ' ' MET . 18.0 mt -65.57 -17.68 64.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.717 0.294 . . . . 0.0 111.294 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -69.93 -47.28 63.01 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 172.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.2 tp -66.3 -19.64 65.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.582 174.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.545 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 11.1 t-80 -68.19 -41.84 80.82 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.718 175.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.692 ' CD2' HG22 ' A' ' 100' ' ' VAL . 4.8 m-30 -66.49 -28.53 68.65 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.482 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.934 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 64.8 t80 -73.29 -53.87 9.77 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.649 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.481 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -79.62 -12.99 59.81 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.206 -175.025 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.403 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.1 tpt -44.52 -41.3 6.31 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.839 0.712 . . . . 0.0 111.901 -174.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.506 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -140.81 9.91 2.19 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.863 179.573 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.524 ' HB2' HD21 ' A' ' 88' ' ' LEU . 27.3 t70 -86.26 88.81 7.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 110.268 178.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.506 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 21.7 m-85 -106.14 14.53 27.56 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.37 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -112.94 -15.41 12.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.319 -176.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 60.23 27.24 64.97 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.743 -0.662 . . . . 0.0 114.426 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -89.3 3.33 52.48 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 117.766 0.783 . . . . 0.0 110.765 -178.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.934 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 2.6 t30 68.84 20.3 8.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.425 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.534 HD22 ' HB2' ' A' ' 135' ' ' TYR . 40.8 mt -143.27 158.47 43.6 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.574 0.702 . . . . 0.0 111.248 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.589 HD11 ' HA ' ' A' ' 77' ' ' PHE . 70.6 mt -125.78 118.12 24.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.391 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.57 169.66 12.57 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.94 -35.69 54.16 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.403 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.5 mt -59.07 -42.8 91.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.262 0.553 . . . . 0.0 110.594 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.421 ' HA ' ' ND1' ' A' ' 80' ' ' HIS . 37.3 mt-10 -70.76 -50.59 34.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.035 0.921 . . . . 0.0 109.203 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 97' ' ' ILE . 29.4 mt -65.77 -12.22 52.17 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.733 -171.48 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.717 ' HA ' HD13 ' A' ' 121' ' ' ILE . 24.4 p -55.61 -31.95 62.7 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.545 0.212 . . . . 0.0 111.4 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.83 -36.82 14.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.234 0.54 . . . . 0.0 111.145 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.57 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.2 -43.91 20.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.744 -168.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.894 HD12 HG21 ' A' ' 124' ' ' VAL . 32.6 mm -62.82 -20.52 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.673 -174.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.713 HG23 HD21 ' A' ' 117' ' ' LEU . 17.5 m -56.39 -21.3 24.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.488 174.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -108.67 -44.5 4.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.207 174.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.692 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.9 t -59.16 -48.79 85.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.67 -173.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' HIS . . . . . 0.47 ' CD2' HG13 ' A' ' 120' ' ' ILE . 27.8 t60 . . . . . 0 N--CA 1.449 -0.522 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.765 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.507 -0.695 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 3.4 Cg_exo -79.41 67.73 8.51 Favored 'Trans proline' 0 N--CA 1.439 -1.702 0 C-N-CA 121.496 1.464 . . . . 0.0 111.379 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.71 83.47 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.945 0.879 . . . . 0.0 110.779 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.456 ' H ' ' HG2' ' A' ' 112' ' ' MET . 12.8 ptt? -102.95 -54.24 2.67 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.837 -176.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.7 m -161.38 119.15 2.31 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.62 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.04 -40.67 67.29 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.961 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.466 ' HA ' HD12 ' A' ' 118' ' ' ILE . 33.9 m-20 -71.9 -40.67 68.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.793 0.33 . . . . 0.0 110.926 -178.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -63.89 -37.02 85.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.469 0.652 . . . . 0.0 109.357 173.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.713 HD21 HG23 ' A' ' 98' ' ' THR . 12.5 tp -65.93 -31.97 73.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.066 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 114' ' ' GLU . 88.1 mt -61.18 -45.19 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.895 0.379 . . . . 0.0 110.249 174.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -66.76 -31.79 72.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.844 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.571 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -62.31 -42.57 95.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.202 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.887 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.3 mt -64.59 -48.27 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.903 176.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 70.6 m-20 -50.81 -48.17 59.78 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.25 -28.42 34.66 Favored Glycine 0 C--O 1.224 -0.471 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.491 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.894 HG21 HD12 ' A' ' 97' ' ' ILE . 54.9 t -72.08 -55.04 14.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 O-C-N 122.708 -0.289 . . . . 0.0 111.125 174.459 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.8 mp -65.92 -13.98 60.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.313 0.578 . . . . 0.0 111.044 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 47.7 mtt180 -110.48 -29.59 8.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.881 -175.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -125.91 -46.44 1.69 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.549 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 19.3 m-20 -68.06 -22.52 64.93 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 121.243 0.544 . . . . 0.0 110.275 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.486 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 0.8 OUTLIER -76.09 99.53 4.67 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.818 168.626 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -80.75 -17.43 51.0 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.657 -171.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.88 -0.08 43.11 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.531 -173.086 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.6 m120 61.75 37.53 15.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.996 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -99.6 -19.62 16.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.52 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 85.87 6.54 82.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.436 178.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.534 ' HB2' HD22 ' A' ' 87' ' ' LEU . 50.9 m-85 -126.78 160.74 29.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.665 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.501 HG22 ' HB2' ' A' ' 88' ' ' LEU . 7.3 tt -110.86 117.39 54.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.082 0.944 . . . . 0.0 110.568 178.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -90.33 168.64 11.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.258 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.797 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 7.3 t80 -51.83 -47.24 64.43 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.37 -26.49 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.04 0.447 . . . . 0.0 110.984 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.486 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 44.2 mt-10 -76.12 -53.31 8.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.97 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.797 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -72.49 -26.39 61.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.587 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.71 -42.42 97.19 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 174.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.428 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.5 mtmm -71.57 -28.92 64.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.781 176.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.1 t -80.21 -39.09 29.83 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.727 -172.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.991 -178.111 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.63 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.1 mmm . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 120.653 0.263 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -91.74 156.58 42.67 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.858 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.42 -50.75 12.82 Favored 'Trans proline' 0 N--CA 1.475 0.436 0 C-N-CA 122.85 2.367 . . . . 0.0 114.146 -173.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -62.45 -42.76 99.7 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.765 -174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 17.5 pt-20 -77.6 -27.33 51.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.059 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.63 HD21 ' HB2' ' A' ' 67' ' ' MET . 13.5 mt -68.23 -17.96 64.44 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 120.745 0.307 . . . . 0.0 111.479 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.491 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 16.2 mt-30 -70.76 -45.74 64.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 171.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.76 -20.62 66.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.641 173.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.525 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 62.3 t60 -68.7 -33.24 73.61 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.385 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.429 ' HD1' HG22 ' A' ' 100' ' ' VAL . 4.3 m-30 -72.12 -31.51 66.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 175.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.659 ' HB2' ' HZ ' ' A' ' 141' ' ' PHE . 47.6 t80 -69.03 -53.2 21.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.284 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.57 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.56 -10.4 59.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.678 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.497 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 4.8 tpt -44.08 -39.43 4.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.904 0.881 . . . . 0.0 112.749 -171.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.518 ' O ' ' HG3' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -144.74 10.21 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.344 -178.92 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.795 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.5 t70 -74.83 94.84 2.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.617 0.722 . . . . 0.0 110.819 -176.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -122.02 18.83 10.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.652 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -108.08 -13.67 14.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -178.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 70.74 15.25 73.45 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.509 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -95.13 -4.85 45.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.657 0.728 . . . . 0.0 111.012 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.409 ' O ' HD22 ' A' ' 87' ' ' LEU . 47.2 m-80 62.69 19.76 11.6 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.691 177.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.537 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.4 mm? -129.14 163.31 25.79 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.656 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 86.9 mt -120.09 113.74 20.93 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 121.212 -0.195 . . . . 0.0 110.685 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.508 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 0.0 OUTLIER -86.25 175.66 8.35 Favored 'General case' 0 C--O 1.209 -1.059 0 O-C-N 123.794 0.684 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.44 -53.72 23.41 Favored Glycine 0 CA--C 1.518 0.232 0 N-CA-C 114.548 0.579 . . . . 0.0 114.548 -176.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.618 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.9 pp -80.33 -28.63 38.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.574 0.687 . . . . 0.0 111.573 -172.435 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.795 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 40.7 tt0 -70.54 -51.45 28.61 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.891 0.853 . . . . 0.0 108.866 173.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 1.025 ' HG ' HG12 ' A' ' 97' ' ' ILE . 17.1 tp -65.95 -12.57 55.81 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.018 -179.165 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.805 ' HA ' HD13 ' A' ' 121' ' ' ILE . 28.0 m -52.96 -31.89 42.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.187 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 m -87.71 -22.26 24.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.07 0.462 . . . . 0.0 111.287 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.795 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -93.08 -39.18 11.22 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -171.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 1.025 HG12 ' HG ' ' A' ' 93' ' ' LEU . 43.6 mm -64.83 -21.55 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-O 120.962 0.41 . . . . 0.0 110.777 -179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.866 HG23 HD21 ' A' ' 117' ' ' LEU . 3.4 m -57.9 -24.77 59.21 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -111.78 -27.55 8.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.986 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.769 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 40.5 t -61.7 -59.81 3.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 175.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 49.4 t60 . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 121.312 0.577 . . . . 0.0 110.11 174.708 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.865 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.504 -0.812 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' PRO . . . . . 0.461 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.2 Cg_endo -79.84 67.1 8.72 Favored 'Trans proline' 0 N--CA 1.438 -1.748 0 C-N-CA 121.343 1.362 . . . . 0.0 111.625 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.21 78.97 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 122.144 0.973 . . . . 0.0 110.37 172.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.472 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.4 ptt? -97.76 -56.39 2.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.063 -1.426 . . . . 0.0 110.671 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.0 m -155.62 119.31 4.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.439 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.8 pt-20 -56.9 -37.5 71.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.868 -170.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.53 -45.23 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.451 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.53 -39.43 94.4 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.265 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.866 HD21 HG23 ' A' ' 98' ' ' THR . 13.2 tp -62.23 -38.36 88.93 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.288 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 114' ' ' GLU . 76.5 mt -63.46 -41.88 94.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 174.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -67.26 -30.6 70.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.307 0.575 . . . . 0.0 110.16 175.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.425 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -63.36 -43.0 98.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.1 173.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.805 HD13 ' HA ' ' A' ' 94' ' ' SER . 82.0 mt -63.79 -47.35 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.646 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.722 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 0.5 OUTLIER -52.52 -47.74 66.47 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.363 176.216 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.19 -34.38 53.22 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.18 -0.533 . . . . 0.0 111.903 177.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 52.5 t -65.78 -52.07 54.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.621 0.248 . . . . 0.0 110.661 175.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.425 HD11 HD23 ' A' ' 93' ' ' LEU . 8.9 mp -67.74 -1.05 4.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.67 -177.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.722 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.9 mtm180 -118.2 -32.62 4.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.605 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -123.77 -45.51 2.03 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -176.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.526 ' HB2' HG13 ' A' ' 124' ' ' VAL . 4.4 m-20 -71.97 -17.05 62.09 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.132 0.492 . . . . 0.0 110.4 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.577 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.8 t70 -76.36 93.25 3.44 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 166.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -79.37 -17.59 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.604 -168.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.45 8.07 16.42 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.244 -170.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.421 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 86.8 m-20 61.02 36.2 18.62 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.984 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.7 p30 -98.38 -4.12 35.47 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.784 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.2 -16.27 23.86 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.986 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.537 ' HB2' HD12 ' A' ' 87' ' ' LEU . 16.5 m-85 -116.21 173.94 6.32 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.543 HD13 ' HB3' ' A' ' 141' ' ' PHE . 7.1 tt -108.7 121.98 62.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.705 177.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -91.58 170.11 10.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.345 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.769 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 38.1 t80 -52.33 -48.77 65.28 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.113 0.258 . . . . 0.0 110.63 -178.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.6 -28.01 69.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.928 0.394 . . . . 0.0 111.686 -176.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.577 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 47.7 mt-10 -76.98 -49.21 15.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.481 -173.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.769 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -76.29 -27.99 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.534 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.99 88.01 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.853 0.359 . . . . 0.0 110.553 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.412 ' HE3' ' HB2' ' A' ' 143' ' ' LYS . 47.6 mtmt -77.42 -29.01 52.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.527 175.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 21.7 t -75.58 -34.55 60.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.481 -175.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 pp . . . . . 0 CA--C 1.53 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.464 -178.806 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.647 ' HB2' HD21 ' A' ' 72' ' ' LEU . 96.9 mmm . . . . . 0 N--CA 1.463 0.194 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.449 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 55.3 m -116.8 162.99 24.38 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.451 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 81.1 Cg_exo -50.35 -49.33 16.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.284 2.656 . . . . 0.0 115.222 -172.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.403 ' HG3' ' OE1' ' A' ' 71' ' ' GLU . 19.7 pt20 -59.31 -48.68 80.73 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -172.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.449 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 1.7 pm0 -72.98 -28.65 62.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.707 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 67' ' ' MET . 27.6 mt -68.09 -17.62 64.43 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.166 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.451 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 28.7 mt-30 -69.59 -47.46 63.46 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.084 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.91 -19.36 65.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.697 173.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.571 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 10.2 t-80 -71.57 -42.29 68.0 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.908 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.793 ' CD2' HG22 ' A' ' 100' ' ' VAL . 7.4 m-30 -66.95 -29.09 68.86 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.557 ' HA ' HD11 ' A' ' 88' ' ' LEU . 58.0 t80 -73.01 -50.39 23.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.864 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.453 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.3 mmmt -80.94 -26.62 36.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -175.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.3 tpp -44.72 -53.94 6.79 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -170.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.469 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -122.54 9.18 9.6 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.438 -174.532 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.673 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.0 t70 -83.89 72.8 10.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 109.554 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.423 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.8 OUTLIER -98.17 -7.02 30.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.915 -178.461 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -77.22 -13.65 59.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.8 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.3 24.06 74.19 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.414 -0.812 . . . . 0.0 113.381 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.476 ' ND2' ' HB2' ' A' ' 87' ' ' LEU . 14.1 p-10 -104.57 -9.71 18.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 117.64 0.72 . . . . 0.0 111.719 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.8 m120 67.71 30.21 6.54 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.57 HD22 ' HB2' ' A' ' 135' ' ' TYR . 13.6 mt -138.47 163.95 30.63 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.298 -0.865 . . . . 0.0 108.939 172.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.557 HD11 ' HA ' ' A' ' 77' ' ' PHE . 84.2 mt -125.86 117.51 23.52 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 123.23 0.331 . . . . 0.0 110.974 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.598 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.7 p30 -98.87 -170.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.317 177.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.12 -50.22 56.36 Favored Glycine 0 C--N 1.329 0.177 0 N-CA-C 114.32 0.488 . . . . 0.0 114.32 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.694 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.7 pp -75.0 -29.48 60.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.52 0.66 . . . . 0.0 110.749 -173.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.694 ' N ' HD12 ' A' ' 91' ' ' LEU . 47.9 mt-10 -68.8 -50.04 53.55 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 97' ' ' ILE . 40.8 mt -66.82 -13.17 61.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.959 -178.658 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.649 ' HA ' HD13 ' A' ' 121' ' ' ILE . 48.4 m -57.39 -32.24 66.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.646 0.26 . . . . 0.0 111.321 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 m -92.39 -33.45 14.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 110.883 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.681 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.98 -51.08 8.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.091 -169.086 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.867 HD12 HG21 ' A' ' 124' ' ' VAL . 24.3 mm -57.66 -24.68 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.908 -174.305 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.637 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 4.2 m -58.4 -22.14 52.91 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.188 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.511 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 43.8 m-70 -106.67 -19.84 13.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.826 174.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.793 HG22 ' CD2' ' A' ' 76' ' ' TYR . 12.4 t -86.01 -60.14 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -170.463 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' HIS . . . . . 0.43 ' CD2' HG13 ' A' ' 120' ' ' ILE . 74.1 t60 . . . . . 0 C--O 1.235 0.3 0 O-C-N 123.373 0.42 . . . . 0.0 111.766 -170.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.492 ' HB2' ' CE1' ' A' ' 99' ' ' HIS . . . . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 110.462 -0.199 . . . . 0.0 110.462 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' PRO . . . . . 0.637 ' HD2' ' O ' ' A' ' 98' ' ' THR . 45.4 Cg_endo -71.02 63.94 2.53 Favored 'Trans proline' 0 N--CA 1.455 -0.735 0 C-N-CA 122.11 1.873 . . . . 0.0 111.769 170.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.94 79.03 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.742 0.782 . . . . 0.0 111.299 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.405 ' H ' ' HG2' ' A' ' 112' ' ' MET . 18.3 ptt? -90.55 -59.16 2.25 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.67 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 75.4 m -167.36 129.93 1.68 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.596 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.4 OUTLIER -62.18 -28.26 69.54 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 123.264 0.352 . . . . 0.0 111.861 -175.028 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.71 -42.42 70.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -64.14 -40.71 96.74 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.506 HD11 ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER -62.76 -36.26 82.49 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.919 -1.492 . . . . 0.0 110.563 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.596 HG13 ' O ' ' A' ' 114' ' ' GLU . 68.6 mt -60.37 -43.48 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.904 0.383 . . . . 0.0 110.374 175.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.61 -38.32 87.19 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.606 0.717 . . . . 0.0 109.648 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.467 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -64.22 -39.99 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.3 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.805 ' HA ' HG21 ' A' ' 97' ' ' ILE . 79.2 mt -65.71 -41.82 91.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.466 178.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.767 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.1 t70 -62.94 -43.3 99.18 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.15 -30.39 57.66 Favored Glycine 0 C--O 1.224 -0.498 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.276 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 45.6 t -65.43 -49.28 79.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.747 0.308 . . . . 0.0 110.932 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 134' ' ' GLY . 96.2 mt -67.82 -9.89 48.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.995 0.426 . . . . 0.0 111.195 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.767 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.4 mtp85 -107.93 -34.78 6.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.308 -178.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -121.62 -47.31 2.22 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -171.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.539 ' HB2' HG13 ' A' ' 124' ' ' VAL . 15.1 m-20 -71.94 -21.11 61.65 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.058 0.456 . . . . 0.0 110.788 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.537 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.2 t70 -76.66 91.44 3.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 168.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -78.43 -18.25 55.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.627 -167.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -117.25 16.02 14.87 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.789 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 56.84 44.16 23.74 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.563 170.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.08 -15.46 15.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.692 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.407 ' O ' HD22 ' A' ' 125' ' ' LEU . . . 87.82 1.97 82.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.203 176.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.57 ' HB2' HD22 ' A' ' 87' ' ' LEU . 45.9 m-85 -132.74 170.88 14.62 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.499 HG22 HD21 ' A' ' 93' ' ' LEU . 7.1 tt -111.35 122.49 65.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.331 0.586 . . . . 0.0 109.739 174.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -103.3 -177.04 3.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.099 176.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.851 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.3 t80 -55.04 -48.99 72.7 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.551 0.532 . . . . 0.0 111.694 -171.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -23.18 64.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.004 0.43 . . . . 0.0 111.464 -175.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.537 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 51.7 mt-10 -80.69 -53.11 6.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -174.015 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.851 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.8 p90 -68.88 -32.11 71.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.047 177.593 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.77 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.998 0.428 . . . . 0.0 110.671 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -72.72 -29.34 63.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.38 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 9.0 t -79.84 -25.47 40.77 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -174.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.827 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 76.5 mt . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.311 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.652 ' HB2' HD21 ' A' ' 72' ' ' LEU . 93.5 mmm . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.828 0.347 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.545 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 5.8 m -85.53 153.83 58.84 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.874 177.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.604 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 18.9 Cg_endo -59.77 -26.96 83.8 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.463 2.775 . . . . 0.0 114.698 -169.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.436 ' HG3' ' H ' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -68.68 -54.92 13.35 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 121.421 0.629 . . . . 0.0 109.939 -177.155 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.545 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 1.7 pm0 -67.85 -27.04 66.35 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.249 174.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.751 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 15.1 mt -65.88 -20.62 66.29 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.403 177.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.768 ' HG2' HD13 ' A' ' 145' ' ' LEU . 20.8 mt-30 -72.22 -40.83 67.5 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.01 -24.38 65.11 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.751 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 18.0 t60 -68.92 -39.17 79.78 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.096 176.083 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.77 ' CD2' HG22 ' A' ' 100' ' ' VAL . 3.9 m-30 -66.94 -34.95 78.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.279 0.561 . . . . 0.0 109.813 175.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.54 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 59.1 t80 -68.48 -53.35 23.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.24 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.405 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 28.0 mmmt -80.28 -12.33 59.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.61 -175.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.49 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.4 tpt -44.62 -38.89 4.59 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.928 0.768 . . . . 0.0 112.435 -172.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.622 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 1.0 OUTLIER -146.5 11.49 1.14 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.293 -179.645 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.743 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 25.0 t70 -82.56 90.9 6.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.614 0.721 . . . . 0.0 110.326 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -105.01 -10.84 16.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.4 p30 -83.89 -13.7 52.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.606 -173.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 64.09 24.43 68.7 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.358 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -95.07 5.12 52.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.343 0.572 . . . . 0.0 111.018 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.54 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 19.6 m120 59.19 32.34 21.96 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.129 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 27.5 mt -151.31 160.14 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.63 178.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.602 ' HB2' HG22 ' A' ' 136' ' ' ILE . 60.7 mt -121.32 123.54 42.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.503 176.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.578 ' OD2' ' HG ' ' A' ' 91' ' ' LEU . 0.1 OUTLIER -92.37 177.81 6.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.583 176.71 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.27 -34.71 54.09 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.206 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.578 ' HG ' ' OD2' ' A' ' 89' ' ' ASP . 27.7 mt -71.08 -47.05 60.49 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.176 0.512 . . . . 0.0 110.099 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.743 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 50.6 mt-10 -62.45 -41.59 98.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.547 0.689 . . . . 0.0 109.586 174.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.677 ' HB3' HG12 ' A' ' 97' ' ' ILE . 34.1 mt -68.44 -15.03 63.4 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.744 -175.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.777 ' HA ' HD13 ' A' ' 121' ' ' ILE . 26.6 t -59.9 -32.48 70.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.074 0.464 . . . . 0.0 110.445 178.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 -30.26 17.78 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.393 0.616 . . . . 0.0 110.382 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.573 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -86.22 -55.49 3.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.969 -171.155 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.949 HD12 HG21 ' A' ' 124' ' ' VAL . 33.6 mm -59.03 -25.22 29.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 122.731 0.412 . . . . 0.0 111.793 -174.434 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.686 HG23 HD21 ' A' ' 117' ' ' LEU . 23.4 m -59.38 -16.06 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.219 0.533 . . . . 0.0 110.867 175.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 43.4 m-70 -110.77 -23.31 11.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.499 174.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.77 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.1 t -85.19 -45.9 17.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.731 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 . . . . . 0 N--CA 1.451 -0.38 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.838 -176.812 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.584 ' HA ' ' O ' ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.506 -0.738 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -85.06 69.36 5.69 Favored 'Trans proline' 0 N--CA 1.434 -1.98 0 C-N-CA 121.738 1.626 . . . . 0.0 110.711 176.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.8 mt -61.07 78.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.958 0.885 . . . . 0.0 111.04 174.147 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.486 ' H ' ' HG2' ' A' ' 112' ' ' MET . 11.6 ptt? -92.74 -56.97 2.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.474 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.9 m -158.61 125.76 4.89 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.421 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.52 -37.86 68.46 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.036 -176.546 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -60.24 -49.24 78.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.435 0.636 . . . . 0.0 110.11 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.13 -41.21 90.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.922 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.686 HD21 HG23 ' A' ' 98' ' ' THR . 8.1 tp -60.79 -39.69 89.82 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.561 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 114' ' ' GLU . 43.5 mt -59.01 -44.27 90.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.636 176.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -69.77 -31.61 69.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.645 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.406 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -60.85 -46.5 96.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.125 174.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.912 ' HA ' HG21 ' A' ' 97' ' ' ILE . 83.9 mt -63.03 -47.26 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.251 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.808 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.8 t70 -60.5 -42.27 96.01 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.729 -179.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.49 -32.79 46.27 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.401 176.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.949 HG21 HD12 ' A' ' 97' ' ' ILE . 30.4 t -61.6 -51.1 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.7 0.286 . . . . 0.0 110.426 173.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.44 HD11 HD12 ' A' ' 93' ' ' LEU . 7.8 mp -66.54 -10.81 48.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.129 0.49 . . . . 0.0 110.993 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.808 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 25.8 mtp180 -99.67 -32.96 10.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.568 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -136.5 -43.28 0.61 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -171.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.653 ' HB3' HG13 ' A' ' 124' ' ' VAL . 32.0 t0 -72.95 -22.15 60.76 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.383 0.611 . . . . 0.0 110.554 -176.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.26 101.18 6.13 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 168.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -78.42 -29.96 47.39 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.25 -168.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.02 -4.12 59.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.944 -174.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 66.9 t30 59.11 36.43 24.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.741 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -96.81 -20.78 17.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.117 -176.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 106.24 -20.46 35.27 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.857 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -114.71 161.58 17.95 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.071 0.462 . . . . 0.0 110.554 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.602 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.5 tt -107.04 125.88 63.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.411 175.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -104.13 -176.86 3.2 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.822 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 10.8 t80 -54.49 -43.66 71.97 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.441 0.463 . . . . 0.0 111.494 -174.052 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.82 -37.05 81.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.577 0.227 . . . . 0.0 111.227 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.48 ' OE1' ' HA ' ' A' ' 136' ' ' ILE . 50.7 mt-10 -71.45 -53.4 14.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.986 -171.113 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.822 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -70.04 -23.17 63.06 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.825 -178.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.611 ' HA ' HD12 ' A' ' 145' ' ' LEU . . . -79.65 -32.89 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.204 0.526 . . . . 0.0 110.496 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -69.55 -33.01 72.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.022 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 1.4 p -81.95 -30.57 31.66 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.768 HD13 ' HG2' ' A' ' 73' ' ' GLN . 6.7 mt . . . . . 0 C--O 1.233 0.222 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.149 170.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.629 ' HB2' HD21 ' A' ' 72' ' ' LEU . 97.2 mmm . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.473 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 20.3 m -93.54 158.23 37.14 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.912 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.541 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.4 Cg_exo -51.5 -45.68 36.18 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.129 2.552 . . . . 0.0 114.312 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -57.24 -54.73 43.52 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.023 -173.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.473 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 3.6 pm0 -71.16 -33.3 69.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.88 177.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.656 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 13.9 mt -62.72 -21.06 65.51 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.319 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.803 ' HG2' HD21 ' A' ' 145' ' ' LEU . 86.3 mt-30 -67.17 -48.03 69.21 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 173.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.2 tp -64.04 -22.34 66.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.526 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.656 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 11.9 t-80 -72.01 -43.24 65.36 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.131 178.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.562 ' CE2' HD22 ' A' ' 145' ' ' LEU . 5.3 m-30 -62.82 -32.97 74.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 176.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 32.5 t80 -70.96 -52.65 18.56 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.206 -1.361 . . . . 0.0 110.46 -178.006 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -79.89 -21.31 44.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.717 -175.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 19.1 tpp -44.95 -52.99 8.17 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 123.796 0.685 . . . . 0.0 112.2 -173.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.672 ' HA ' ' CE2' ' A' ' 82' ' ' TYR . 1.8 m170 -122.94 9.88 9.44 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.008 -175.706 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.566 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.0 t70 -82.69 56.01 3.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.78 0.8 . . . . 0.0 109.917 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.672 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 47.5 m-85 -71.95 -23.97 61.53 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.713 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.8 p30 -71.83 -14.88 62.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.685 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.74 28.27 65.33 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.132 -0.94 . . . . 0.0 113.491 177.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -96.07 3.81 53.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.498 0.649 . . . . 0.0 111.775 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.491 ' HA ' ' CZ ' ' A' ' 77' ' ' PHE . 12.5 m120 65.61 25.18 11.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.216 0.532 . . . . 0.0 111.492 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.487 HD22 ' HB2' ' A' ' 135' ' ' TYR . 13.4 mt -147.19 156.5 43.02 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.682 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.621 ' HB2' HG22 ' A' ' 136' ' ' ILE . 75.8 mt -123.74 121.16 34.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.9 0.381 . . . . 0.0 111.536 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.472 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 13.4 t70 -83.21 168.29 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.394 173.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.51 55.21 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.609 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.472 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.4 mt -61.55 -43.31 99.09 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.491 0.662 . . . . 0.0 110.442 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.566 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.0 mt-10 -67.43 -46.53 72.88 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.959 0.885 . . . . 0.0 109.111 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.788 ' HB3' HG12 ' A' ' 97' ' ' ILE . 24.5 mt -66.61 -9.95 40.77 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.379 -173.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.693 ' HA ' HD13 ' A' ' 121' ' ' ILE . 36.2 t -54.4 -34.73 61.88 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.642 0.258 . . . . 0.0 111.301 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m -91.19 -30.99 16.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.395 -0.522 . . . . 0.0 111.244 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.59 -46.07 14.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.828 -171.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.855 HG21 ' HA ' ' A' ' 121' ' ' ILE . 43.6 mm -65.16 -22.18 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.364 -175.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.69 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 11.2 m -62.73 -15.27 52.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.44 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 61.9 m-70 -114.91 -25.76 8.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 174.049 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.707 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 58.7 t -66.3 -60.77 2.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.525 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 78.1 t60 . . . . . 0 C--O 1.233 0.237 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.908 -179.186 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.502 -0.882 0 N-CA-C 110.41 -0.218 . . . . 0.0 110.41 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' PRO . . . . . 0.69 ' HD2' ' O ' ' A' ' 98' ' ' THR . 57.3 Cg_endo -74.99 71.73 4.89 Favored 'Trans proline' 0 N--CA 1.443 -1.466 0 C-N-CA 121.273 1.315 . . . . 0.0 111.82 174.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.67 76.15 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.669 0.747 . . . . 0.0 110.623 170.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 22.5 ptt? -89.55 -59.23 2.27 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.398 -177.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.7 m -163.04 117.49 1.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.482 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.47 -35.29 65.36 Favored 'General case' 0 C--O 1.219 -0.504 0 O-C-N 123.739 0.649 . . . . 0.0 112.03 -174.27 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -65.15 -47.05 78.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.114 0.483 . . . . 0.0 110.53 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.9 -38.62 79.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.682 176.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.429 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.1 tm? -58.0 -39.62 78.71 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.947 177.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 114' ' ' GLU . 39.9 mt -60.6 -46.02 96.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.067 175.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -64.7 -33.49 76.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.298 0.571 . . . . 0.0 110.209 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.3 mp -61.62 -47.92 91.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.437 175.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.855 ' HA ' HG21 ' A' ' 97' ' ' ILE . 70.4 mt -61.92 -43.96 98.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.64 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.653 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.6 t70 -63.08 -39.58 95.12 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.821 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.67 -28.84 60.51 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.911 177.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.826 HG21 HD12 ' A' ' 97' ' ' ILE . 45.5 t -61.8 -51.04 77.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.839 0.352 . . . . 0.0 110.918 174.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.38 -13.07 61.68 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.168 0.509 . . . . 0.0 110.9 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.653 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.6 mtm-85 -94.71 -50.06 5.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.626 -177.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -125.58 -31.61 2.96 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -173.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.549 ' CB ' ' HA ' ' A' ' 124' ' ' VAL . 9.6 t0 -75.14 -23.43 57.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.177 0.513 . . . . 0.0 110.637 -174.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.07 103.97 4.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 167.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -81.79 -18.66 43.33 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.417 -174.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ASN . . . . . 0.486 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.1 m120 -83.3 -14.23 53.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.234 -172.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 131' ' ' ASN . 26.8 m-80 67.59 34.42 4.57 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.811 0.694 . . . . 0.0 110.365 -173.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.486 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -102.01 -21.36 14.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.8 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.27 4.61 77.29 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.466 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.487 ' HB2' HD22 ' A' ' 87' ' ' LEU . 59.6 m-85 -127.65 167.84 15.86 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.621 HG22 ' HB2' ' A' ' 88' ' ' LEU . 4.6 tt -107.86 122.69 62.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.93 0.872 . . . . 0.0 110.498 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -95.48 166.46 11.85 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.364 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.814 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 14.9 t80 -48.37 -47.68 37.21 Favored 'General case' 0 CA--C 1.523 -0.07 0 O-C-N 123.065 0.228 . . . . 0.0 110.869 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.386 -178.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.02 -50.27 64.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.89 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.814 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.2 p90 -74.03 -34.27 64.05 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.71 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.57 84.55 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.993 0.425 . . . . 0.0 110.239 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -72.2 -31.61 66.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.094 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 41.6 t -84.59 -37.04 21.63 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.367 -173.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.803 HD21 ' HG2' ' A' ' 73' ' ' GLN . 3.5 pp . . . . . 0 CA--C 1.53 0.196 0 CA-C-O 120.943 0.401 . . . . 0.0 110.963 -176.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.514 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 97.6 mmm . . . . . 0 N--CA 1.463 0.2 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.812 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 2.9 p -95.46 170.04 8.37 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.664 -0.207 . . . . 0.0 110.939 179.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.812 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 33.6 Cg_endo -61.9 -37.77 63.55 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.356 2.037 . . . . 0.0 114.252 -164.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -54.55 45.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.153 -174.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -76.46 -28.83 56.69 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.003 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.514 ' CD2' ' HB2' ' A' ' 67' ' ' MET . 12.1 mt -63.21 -19.81 64.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.653 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -71.75 -45.42 61.75 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.37 -23.93 67.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.71 172.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.486 ' O ' ' HB2' ' A' ' 79' ' ' MET . 11.0 t-80 -66.94 -39.78 87.39 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.787 176.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.841 ' HE1' HD21 ' A' ' 145' ' ' LEU . 5.2 m-30 -69.21 -25.65 64.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.264 0.554 . . . . 0.0 110.024 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.672 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 44.3 t80 -75.39 -54.23 7.4 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.819 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.672 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.9 mmmt -81.03 -17.38 50.43 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.486 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -45.74 -25.75 0.54 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.103 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.816 ' HE1' HD23 ' A' ' 93' ' ' LEU . 0.2 OUTLIER -157.93 9.56 0.17 Allowed 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.003 -165.385 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.548 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 27.8 t70 -89.12 61.78 5.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.736 0.779 . . . . 0.0 109.627 -176.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.438 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 11.6 m-85 -76.44 -24.13 53.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.932 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -70.34 -14.49 62.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.998 -174.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 63.13 28.14 71.67 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.85 -0.614 . . . . 0.0 113.218 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -96.76 -2.78 43.62 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 117.465 0.633 . . . . 0.0 110.396 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 59.11 34.98 23.63 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.519 HD22 ' HB2' ' A' ' 135' ' ' TYR . 7.6 mt -150.9 155.87 40.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.403 177.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.605 ' HB2' HG22 ' A' ' 136' ' ' ILE . 2.3 mm? -114.48 112.04 22.35 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.567 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 12.7 t70 -82.9 161.98 21.7 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 173.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.5 ' HA2' ' HB2' ' A' ' 93' ' ' LEU . . . -54.93 -32.73 56.2 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.103 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.567 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 32.1 mt -59.73 -49.02 79.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.972 0.415 . . . . 0.0 110.31 178.519 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.548 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.6 mt-10 -63.28 -50.2 71.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.692 0.758 . . . . 0.0 109.15 173.352 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.816 HD23 ' HE1' ' A' ' 80' ' ' HIS . 46.2 mt -58.96 -15.11 11.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.548 -1.205 . . . . 0.0 113.432 -171.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.885 ' HA ' HD13 ' A' ' 121' ' ' ILE . 65.4 p -52.21 -33.68 42.19 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.294 0.371 . . . . 0.0 111.865 -178.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.39 -31.34 16.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.591 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -94.93 -33.51 12.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -170.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.815 HD12 HG21 ' A' ' 124' ' ' VAL . 31.1 mm -63.67 -18.08 21.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.28 0.562 . . . . 0.0 110.283 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.695 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 2.6 m -60.01 -14.85 18.21 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.683 172.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -115.81 -39.99 3.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.706 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.6 t -60.54 -53.59 46.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.984 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 64.3 t60 . . . . . 0 N--CA 1.451 -0.398 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 172.766 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 N--CA 1.443 -0.777 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' PRO . . . . . 0.695 ' HD2' ' O ' ' A' ' 98' ' ' THR . 39.2 Cg_endo -69.86 60.58 1.74 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.373 2.048 . . . . 0.0 111.665 172.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.49 77.53 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 121.931 0.872 . . . . 0.0 109.528 175.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.458 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.5 ptt? -83.52 -53.71 5.49 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.982 -1.463 . . . . 0.0 109.891 178.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 58.3 m -164.42 131.97 3.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 175.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.537 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.5 OUTLIER -61.85 -33.65 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.54 -173.695 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -70.51 -40.41 73.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 110.388 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -67.76 -37.72 82.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.653 HD21 HG23 ' A' ' 98' ' ' THR . 9.4 tp -62.02 -42.06 98.76 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.149 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.7 mt -56.71 -41.64 75.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.932 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -72.49 -33.82 67.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.722 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.02 -36.34 76.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 177.328 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.885 HD13 ' HA ' ' A' ' 94' ' ' SER . 86.5 mt -65.26 -44.4 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.016 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.753 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 35.0 t70 -63.2 -36.82 84.89 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.02 -32.0 59.2 Favored Glycine 0 C--N 1.332 0.334 0 N-CA-C 111.655 -0.578 . . . . 0.0 111.655 174.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.815 HG21 HD12 ' A' ' 97' ' ' ILE . 49.5 t -64.76 -49.16 81.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.883 0.373 . . . . 0.0 110.154 173.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.52 -10.62 36.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.295 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.753 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 29.2 mtm180 -99.09 -48.3 4.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.482 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -118.91 -37.25 3.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.547 ' HB2' HG13 ' A' ' 124' ' ' VAL . 17.5 m-20 -75.15 -19.64 59.77 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.02 0.438 . . . . 0.0 110.869 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.414 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 0.7 OUTLIER -79.45 94.23 5.52 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 167.281 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -79.47 -20.47 47.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.368 -172.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -82.68 -15.37 52.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.414 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 13.8 m120 62.64 37.96 12.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.277 -171.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -103.98 -5.6 22.05 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.36 -18.84 50.49 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.109 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.519 ' HB2' HD22 ' A' ' 87' ' ' LEU . 29.3 m-85 -115.74 166.31 12.09 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 116.983 0.392 . . . . 0.0 110.367 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.605 HG22 ' HB2' ' A' ' 88' ' ' LEU . 8.5 tt -103.4 121.93 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 CA-C-O 121.855 0.836 . . . . 0.0 109.727 176.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.79 172.13 7.25 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.492 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.866 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 19.1 t80 -51.08 -47.37 61.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.28 0.363 . . . . 0.0 110.969 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.5 71.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.373 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -81.34 -50.82 9.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.819 -171.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.866 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -70.22 -34.55 73.03 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.832 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.501 ' HA ' HD12 ' A' ' 145' ' ' LEU . . . -68.07 -31.56 71.28 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.006 0.432 . . . . 0.0 110.465 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -76.68 -27.9 55.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.04 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.0 t -78.5 -18.69 54.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.841 HD21 ' HE1' ' A' ' 76' ' ' TYR . 76.8 mt . . . . . 0 N--CA 1.452 -0.356 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.562 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.63 ' HB2' HD21 ' A' ' 72' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.369 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.549 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 50.6 m -84.05 157.46 62.89 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.959 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.38 -45.66 36.07 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.101 2.534 . . . . 0.0 114.283 -172.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -64.15 -43.59 94.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.821 -171.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.549 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 2.5 pm0 -77.06 -26.46 53.56 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.372 174.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.63 HD21 ' HB2' ' A' ' 67' ' ' MET . 13.2 mt -63.21 -21.53 66.28 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.511 ' HG2' HD21 ' A' ' 145' ' ' LEU . 24.6 mt-30 -68.89 -44.99 72.09 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.49 -19.05 65.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.583 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.557 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 14.7 t-80 -69.55 -34.15 73.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.373 -0.376 . . . . 0.0 109.992 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.706 ' CD2' HG22 ' A' ' 100' ' ' VAL . 5.1 m-30 -72.06 -27.83 62.94 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.568 ' O ' HD11 ' A' ' 88' ' ' LEU . 34.6 t80 -73.69 -52.66 12.52 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.738 176.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.55 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.28 -13.03 59.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -175.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.461 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 2.2 tpt -45.57 -38.26 6.29 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.173 0.589 . . . . 0.0 112.285 -173.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.413 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -143.04 11.14 1.77 Allowed 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.041 -178.495 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.745 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 35.1 t70 -79.74 84.33 5.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.648 0.737 . . . . 0.0 110.557 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -119.02 22.59 11.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.183 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.7 p30 -110.86 -14.11 14.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.769 -174.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 68.79 25.9 74.9 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.079 -0.51 . . . . 0.0 113.107 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -101.03 -1.95 32.92 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 117.46 0.63 . . . . 0.0 111.371 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 63.21 27.33 15.53 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.172 176.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.608 HD22 ' HB2' ' A' ' 135' ' ' TYR . 15.5 mt -153.27 167.61 28.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.461 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.568 HD11 ' O ' ' A' ' 77' ' ' PHE . 3.0 mm? -124.39 121.81 35.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.356 -179.009 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.568 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.2 p-10 -104.52 -179.25 3.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.83 -36.79 33.91 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 114.201 0.44 . . . . 0.0 114.201 -177.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.568 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 30.8 mt -64.3 -53.44 48.8 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.321 0.582 . . . . 0.0 110.552 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.745 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 41.6 mt-10 -62.95 -47.98 80.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.916 178.017 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.818 ' HB3' HG12 ' A' ' 97' ' ' ILE . 37.9 mt -66.23 -10.68 44.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.98 -174.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.974 ' HA ' HD13 ' A' ' 121' ' ' ILE . 24.0 t -56.4 -34.52 66.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.734 0.302 . . . . 0.0 110.845 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.9 m -92.22 -28.57 16.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.239 0.542 . . . . 0.0 111.569 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.538 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -83.72 -47.13 11.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.739 -171.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.892 HD12 HG21 ' A' ' 124' ' ' VAL . 33.8 mm -60.14 -20.84 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.383 -175.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.827 HG22 ' HB1' ' A' ' 109' ' ' ALA . 8.9 m -51.02 -30.55 15.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.971 174.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.472 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 68.5 m-70 -103.82 -33.07 9.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.687 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.706 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.5 t -68.06 -51.74 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.478 -173.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 29.9 t60 . . . . . 0 C--O 1.234 0.242 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.847 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.827 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.508 -0.654 0 CA-C-O 120.429 0.157 . . . . 0.0 110.978 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.11 63.3 8.21 Favored 'Trans proline' 0 N--CA 1.445 -1.36 0 C-N-CA 121.886 1.724 . . . . 0.0 111.05 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.4 89.63 0.01 OUTLIER 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.837 0.827 . . . . 0.0 111.402 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.431 ' HG3' ' H ' ' A' ' 113' ' ' SER . 13.2 ptt? -93.48 -59.06 2.1 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.001 178.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.431 ' H ' ' HG3' ' A' ' 112' ' ' MET . 74.9 m -164.63 123.93 1.88 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 178.448 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.625 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.1 OUTLIER -54.04 -34.97 61.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.87 -174.788 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.465 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 21.2 t70 -71.36 -42.68 68.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.948 0.404 . . . . 0.0 110.666 -178.132 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.02 -38.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.859 0.838 . . . . 0.0 108.93 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.679 HD21 HG23 ' A' ' 98' ' ' THR . 9.5 tp -61.25 -37.1 81.88 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.333 177.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.625 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.0 mt -57.13 -43.7 81.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.474 175.484 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -65.49 -39.29 91.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.464 0.65 . . . . 0.0 109.607 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -61.46 -41.44 90.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.008 -0.996 . . . . 0.0 111.171 178.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.974 HD13 ' HA ' ' A' ' 94' ' ' SER . 90.1 mt -65.26 -38.58 82.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.953 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.796 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.8 t70 -63.7 -42.14 98.02 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.35 -32.0 57.25 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.368 176.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.892 HG21 HD12 ' A' ' 97' ' ' ILE . 46.5 t -61.82 -47.88 91.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.949 0.404 . . . . 0.0 110.215 174.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 66.3 mt -67.61 -7.45 26.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.82 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.796 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 22.5 mtp85 -103.48 -47.21 4.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.744 -178.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -112.7 -48.83 2.98 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.6 ' HB2' HG13 ' A' ' 124' ' ' VAL . 20.9 m-20 -68.84 -22.37 64.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.123 -174.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.595 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 6.1 t70 -76.35 80.3 3.1 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.55 -17.96 63.61 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 114.649 -1.159 . . . . 0.0 111.844 -169.09 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -116.85 10.23 14.1 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.928 -172.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.595 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 17.9 m120 53.63 44.63 29.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.579 173.647 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -99.13 -13.09 19.94 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.199 176.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.02 4.17 78.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.128 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.608 ' HB2' HD22 ' A' ' 87' ' ' LEU . 34.4 m-85 -133.65 176.68 8.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.427 HG23 ' HD1' ' A' ' 141' ' ' PHE . 8.3 tt -117.6 119.62 62.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.359 0.6 . . . . 0.0 109.73 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -97.53 -178.67 4.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.823 177.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.763 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.5 t80 -56.03 -47.92 76.93 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 123.44 0.463 . . . . 0.0 111.058 -173.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.99 66.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.959 0.409 . . . . 0.0 111.548 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.575 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 50.9 mt-10 -74.27 -53.87 8.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.849 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.763 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.8 p90 -72.84 -28.83 62.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.876 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.39 81.48 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 110.393 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -73.91 -32.16 63.42 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.025 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' SER . . . . . 0.453 ' HB3' HG12 ' A' ' 100' ' ' VAL . 9.0 t -81.3 -38.81 26.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.039 -171.028 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.511 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.3 pp . . . . . 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.646 -175.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.526 ' HB2' HD21 ' A' ' 72' ' ' LEU . 95.9 mmm . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.664 0.269 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.446 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 9.0 m -82.4 157.74 67.32 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.428 -178.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.551 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 75.0 Cg_exo -50.76 -48.94 18.43 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.902 2.401 . . . . 0.0 114.255 -173.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -59.92 -49.5 77.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.446 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 5.3 pm0 -71.7 -28.92 64.03 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.737 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.526 HD21 ' HB2' ' A' ' 67' ' ' MET . 11.3 mt -64.27 -21.28 66.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.371 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 24.1 mt-30 -69.57 -46.31 66.68 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 49.1 tp -65.15 -20.91 66.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.896 173.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 15.4 t-80 -69.67 -43.3 72.81 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 76' ' ' TYR . 4.2 m-30 -65.69 -25.16 67.19 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.618 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 45.1 t80 -75.6 -53.56 8.4 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.039 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.618 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.3 mmmt -79.9 -30.88 40.22 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -173.15 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 17.3 tpp -47.93 -36.29 12.14 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -170.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.832 ' HE1' HD23 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -135.2 8.37 3.43 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -169.015 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.667 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.0 t70 -88.51 73.03 8.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.016 0.913 . . . . 0.0 109.354 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -72.08 -22.37 61.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.313 -175.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -87.06 -15.89 37.24 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.533 -175.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.418 ' HA2' ' OD1' ' A' ' 81' ' ' ASP . . . 62.58 29.69 74.35 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 115.545 -0.752 . . . . 0.0 114.401 175.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -94.19 6.87 47.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 117.783 0.791 . . . . 0.0 111.464 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 69.79 13.65 8.06 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.839 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.546 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.2 mm? -131.16 152.44 50.44 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.09 0.472 . . . . 0.0 110.309 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.681 HD22 ' CD2' ' A' ' 80' ' ' HIS . 14.5 mt -119.94 109.16 15.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.612 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.618 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 11.1 t70 -75.3 160.93 29.76 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLY . . . . . 0.502 ' HA2' ' HB2' ' A' ' 93' ' ' LEU . . . -53.4 -29.5 38.64 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 121.29 -0.481 . . . . 0.0 112.386 174.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.618 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.8 mt -60.35 -55.26 35.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 110.085 175.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.667 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 34.7 mt-10 -59.37 -53.02 62.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.207 174.356 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.832 HD23 ' HE1' ' A' ' 80' ' ' HIS . 69.1 mt -55.59 -17.07 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.897 -172.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.902 ' HA ' HD13 ' A' ' 121' ' ' ILE . 15.8 t -52.48 -32.01 37.83 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.362 0.414 . . . . 0.0 111.912 -177.431 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -29.4 17.43 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.533 ' HB3' ' CE1' ' A' ' 80' ' ' HIS . . . -98.13 -28.07 13.9 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -168.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.723 ' CG1' ' HB3' ' A' ' 93' ' ' LEU . 34.5 mm -66.52 -17.08 21.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.671 0.748 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.812 HG23 HD21 ' A' ' 117' ' ' LEU . 5.6 m -63.22 -17.2 62.18 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.735 172.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 50.7 m80 -112.46 -21.41 11.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.074 0.464 . . . . 0.0 110.088 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.691 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.1 t -77.76 -59.39 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.149 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' HIS . . . . . 0.54 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.4 t60 . . . . . 0 C--O 1.234 0.24 0 CA-C-O 121.399 0.619 . . . . 0.0 109.811 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.541 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.504 -0.815 0 CA-C-O 120.604 0.24 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 1.1 Cg_endo -83.34 68.73 7.14 Favored 'Trans proline' 0 N--CA 1.432 -2.089 0 C-N-CA 121.708 1.605 . . . . 0.0 111.287 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.07 74.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.049 0.928 . . . . 0.0 110.28 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.484 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.3 ptt? -90.88 -50.75 5.71 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.597 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -159.4 125.45 4.37 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.537 ' O ' HG13 ' A' ' 118' ' ' ILE . 11.5 pt-20 -57.14 -41.88 79.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.391 -176.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -66.34 -50.28 64.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.979 0.418 . . . . 0.0 110.286 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.05 -41.32 78.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.245 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.812 HD21 HG23 ' A' ' 98' ' ' THR . 9.0 tp -63.76 -36.95 85.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 114' ' ' GLU . 87.6 mt -60.57 -44.0 95.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.231 174.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -66.47 -32.26 73.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.047 0.451 . . . . 0.0 110.459 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.54 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.64 -39.01 78.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.572 174.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.902 HD13 ' HA ' ' A' ' 94' ' ' SER . 46.3 mt -74.98 -19.26 16.35 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 CA-C-O 121.191 0.519 . . . . 0.0 110.591 177.506 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.687 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 30.2 t70 -74.11 -41.08 62.18 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.6 -35.92 63.31 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 114.588 -1.187 . . . . 0.0 113.211 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.836 HG13 HD12 ' A' ' 125' ' ' LEU . 7.2 p -62.56 -47.17 94.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 CA-C-N 117.529 0.664 . . . . 0.0 110.533 178.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.836 HD12 HG13 ' A' ' 124' ' ' VAL . 5.4 mp -70.44 -11.81 61.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.847 0.356 . . . . 0.0 111.379 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.687 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 20.2 mtm180 -92.92 -49.28 6.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -125.8 -26.8 3.43 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.67 ' HB2' HG23 ' A' ' 124' ' ' VAL . 41.8 m-20 -79.14 -28.47 42.83 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.685 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.5 96.41 3.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.578 0.704 . . . . 0.0 109.367 171.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -80.85 -18.75 46.36 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.768 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -78.58 -15.76 58.19 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.062 0.458 . . . . 0.0 110.16 -176.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 66.0 t30 59.67 33.28 21.88 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.601 -173.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -97.88 -16.8 19.6 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.275 -178.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.69 -34.62 5.46 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.687 178.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.546 ' HB2' HD12 ' A' ' 87' ' ' LEU . 6.9 m-85 -114.73 168.84 9.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.46 0.63 . . . . 0.0 111.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.668 HG22 HD12 ' A' ' 88' ' ' LEU . 0.2 OUTLIER -95.59 127.48 47.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.333 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -176.44 3.08 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.255 169.166 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.797 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.3 t80 -55.4 -48.09 74.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.569 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.22 -27.35 68.61 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.502 ' OE2' ' HA ' ' A' ' 136' ' ' ILE . 56.6 mt-10 -81.66 -47.93 12.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.79 -173.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.797 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.1 p90 -71.13 -30.44 66.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.494 176.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.27 86.47 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.514 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.46 -29.15 52.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.618 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 22.7 t -80.11 -33.94 38.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.398 -172.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.5 pp . . . . . 0 N--CA 1.465 0.283 0 CA-C-O 120.842 0.353 . . . . 0.0 111.41 -178.872 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.767 ' HB2' HD11 ' A' ' 72' ' ' LEU . 93.0 mmm . . . . . 0 C--O 1.232 0.149 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.425 ' O ' HD13 ' A' ' 72' ' ' LEU . 16.2 m -83.32 155.52 66.46 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.41 -41.36 43.63 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 123.022 2.481 . . . . 0.0 114.152 -172.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 73' ' ' GLN . 12.2 pt20 -57.56 -39.67 77.2 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.039 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.415 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 4.4 mm-40 -67.72 -44.83 76.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.84 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 10.0 mp -61.29 -21.85 64.32 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.075 -168.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.41 ' NE2' ' HA ' ' A' ' 70' ' ' GLN . 18.5 mt-30 -62.85 -49.68 73.91 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HG ' ' HG2' ' A' ' 78' ' ' LYS . 28.1 tp -68.03 -24.31 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.911 174.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.84 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.4 t60 -67.07 -41.54 86.25 Favored 'General case' 0 C--O 1.225 -0.198 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.733 ' CD1' HG22 ' A' ' 100' ' ' VAL . 4.4 m-30 -72.4 -38.04 68.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.634 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.621 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 51.8 t80 -63.66 -51.55 64.62 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.69 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.614 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 23.7 mmmt -79.01 -19.12 52.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.2 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 16.8 tpp -44.16 -50.44 8.67 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.954 0.784 . . . . 0.0 112.203 -173.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -130.0 9.97 5.39 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.414 -0.515 . . . . 0.0 111.549 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.699 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.3 t70 -82.46 72.19 9.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.689 0.757 . . . . 0.0 110.09 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.1 13.58 30.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.059 178.563 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.1 p30 -101.65 -13.71 17.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.835 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 65.18 32.0 82.48 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.561 -0.745 . . . . 0.0 113.3 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -107.52 -4.54 18.3 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.597 0.698 . . . . 0.0 111.763 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.1 m120 68.37 12.31 8.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.027 0.531 . . . . 0.0 112.255 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.564 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -128.54 164.71 22.22 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.562 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 65.7 mt -126.32 119.26 26.9 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.235 174.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.49 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.3 p30 -99.0 -176.72 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 175.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.21 -36.6 52.86 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.758 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.49 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 46.4 mt -63.52 -47.24 82.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.178 0.513 . . . . 0.0 110.29 -177.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.699 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 36.6 mt-10 -69.12 -49.95 52.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.742 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.797 ' HB3' HG12 ' A' ' 97' ' ' ILE . 35.1 mt -63.94 -14.7 55.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.263 -173.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.779 ' HA ' HD13 ' A' ' 121' ' ' ILE . 79.7 p -56.51 -37.54 70.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.859 0.361 . . . . 0.0 111.008 -178.175 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -91.71 -27.15 18.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.348 0.594 . . . . 0.0 111.141 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.627 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -82.27 -48.51 11.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.605 -172.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.933 HG21 ' HA ' ' A' ' 121' ' ' ILE . 30.4 mm -59.66 -25.75 32.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.954 -174.18 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.694 HG23 HD21 ' A' ' 117' ' ' LEU . 20.9 m -55.94 -22.23 25.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.132 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.522 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 90.4 m-70 -110.8 -11.43 14.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.499 177.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.733 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.7 t -95.1 -49.42 12.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -175.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' HIS . . . . . 0.575 ' CD2' HG13 ' A' ' 120' ' ' ILE . 69.8 t60 . . . . . 0 C--N 1.33 -0.274 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.308 -174.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.658 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.503 -0.849 0 CA-C-O 120.875 0.369 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -84.03 68.95 6.58 Favored 'Trans proline' 0 N--CA 1.431 -2.153 0 C-N-CA 121.288 1.326 . . . . 0.0 111.241 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.63 80.23 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 122.115 0.96 . . . . 0.0 110.782 172.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.483 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.1 ptt? -92.86 -58.03 2.46 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.315 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.9 m -159.68 122.11 3.43 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.609 ' O ' HG13 ' A' ' 118' ' ' ILE . 5.0 pm0 -56.44 -34.16 66.56 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.124 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -74.08 -35.23 64.22 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.204 -0.598 . . . . 0.0 110.135 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -68.63 -39.21 80.87 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.694 HD21 HG23 ' A' ' 98' ' ' THR . 11.6 tp -59.92 -39.02 84.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.296 177.41 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.609 HG13 ' O ' ' A' ' 114' ' ' GLU . 95.9 mt -61.22 -44.86 99.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.742 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -65.65 -32.88 74.7 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 109.987 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.575 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.49 -38.68 76.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.537 175.494 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.933 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -68.42 -39.6 81.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.411 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.731 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.5 t70 -61.99 -44.85 95.86 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.119 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.11 -34.4 52.76 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.466 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.813 HG21 HD12 ' A' ' 97' ' ' ILE . 47.3 t -65.04 -48.35 84.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.86 0.362 . . . . 0.0 110.414 175.101 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.447 HD22 ' O ' ' A' ' 134' ' ' GLY . 88.1 mt -67.87 -4.88 14.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.08 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.731 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.4 mtm180 -103.29 -49.21 3.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -120.21 -35.41 3.45 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.656 ' HB2' HG13 ' A' ' 124' ' ' VAL . 26.3 m-20 -78.23 -16.7 57.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.153 0.501 . . . . 0.0 110.288 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.74 90.85 3.44 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -17.04 59.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.731 -167.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -119.94 17.95 12.52 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 54.71 40.23 31.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.442 172.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 p30 -102.53 -11.49 18.49 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.261 177.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.447 ' O ' HD22 ' A' ' 125' ' ' LEU . . . 84.16 1.15 89.63 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.617 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.564 ' HB2' HD12 ' A' ' 87' ' ' LEU . 13.8 m-85 -127.59 178.86 5.83 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.535 HG22 HD21 ' A' ' 93' ' ' LEU . 3.7 tt -121.41 125.53 73.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -103.14 -177.62 3.43 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.104 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.888 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 15.2 t80 -56.66 -48.82 76.76 Favored 'General case' 0 C--O 1.227 -0.128 0 O-C-N 123.3 0.375 . . . . 0.0 110.838 -175.24 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.19 -21.91 64.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.694 0.283 . . . . 0.0 111.558 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -78.52 -56.78 4.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.888 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -67.63 -32.08 72.54 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.855 -0.738 . . . . 0.0 110.097 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.61 -39.95 78.04 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.953 0.406 . . . . 0.0 110.421 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.3 mtmm -75.34 -28.11 59.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.961 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.2 t -79.21 -19.01 51.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.82 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 68.3 mt . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.415 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.493 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 98.9 mmm . . . . . 0 N--CA 1.464 0.24 0 CA-C-O 121.142 0.496 . . . . 0.0 111.732 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.545 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 17.2 m -93.16 163.41 25.24 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.742 -178.49 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.578 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.6 Cg_exo -53.34 -49.92 15.76 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.809 2.339 . . . . 0.0 113.969 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.53 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 2.1 pt20 -61.77 -49.94 74.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.068 -176.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 68' ' ' SER . 0.8 OUTLIER -61.27 -43.34 99.03 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.675 175.077 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.55 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 12.3 mt -62.44 -22.85 66.52 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.702 -173.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.838 ' HG2' HD21 ' A' ' 145' ' ' LEU . 95.6 mt-30 -71.3 -39.67 71.32 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 175.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.51 -24.67 65.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.384 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.55 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 59.3 t60 -65.88 -46.43 78.43 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 175.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.458 ' CD1' HD22 ' A' ' 145' ' ' LEU . 3.3 m-30 -63.69 -33.65 76.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.189 0.519 . . . . 0.0 109.64 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.548 ' HA ' HD11 ' A' ' 88' ' ' LEU . 65.2 t80 -65.62 -51.91 56.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.204 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.454 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 27.4 mmmt -79.69 -15.5 57.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.547 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.4 tpt -45.2 -44.29 10.84 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.597 0.759 . . . . 0.0 112.519 -170.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.551 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -137.41 10.29 2.96 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.706 -177.569 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.714 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.1 t70 -83.2 88.69 6.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.243 0.544 . . . . 0.0 110.21 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.453 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 26.7 m-85 -110.46 -0.91 17.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.149 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -87.64 -14.68 39.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.582 -174.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.97 78.0 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 121.162 -0.542 . . . . 0.0 113.425 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -95.41 -5.4 43.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 117.706 0.753 . . . . 0.0 111.311 -177.127 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 64.84 18.25 11.38 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.177 0.591 . . . . 0.0 112.033 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.591 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -130.4 167.76 18.06 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 172.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.548 HD11 ' HA ' ' A' ' 77' ' ' PHE . 68.1 mt -131.04 117.28 18.93 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.813 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -93.76 -178.93 4.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.143 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -56.68 -33.89 63.64 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.128 -0.558 . . . . 0.0 113.331 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 19.9 mt -69.55 -48.38 60.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.176 0.512 . . . . 0.0 109.932 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.714 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 45.6 mt-10 -62.99 -49.24 75.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.886 0.85 . . . . 0.0 109.39 174.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.805 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.2 mt -66.57 -9.84 39.31 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.924 -1.034 . . . . 0.0 113.407 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' SER . . . . . 1.03 ' HA ' HD13 ' A' ' 121' ' ' ILE . 34.6 t -54.57 -31.64 57.03 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.024 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.05 -36.75 13.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 0.0 111.339 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.49 -39.26 22.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.845 -168.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.805 HG12 ' HB3' ' A' ' 93' ' ' LEU . 39.1 mm -67.87 -16.33 20.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.959 0.409 . . . . 0.0 111.16 -176.205 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.568 HG23 HD21 ' A' ' 117' ' ' LEU . 8.7 m -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.471 175.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 64.3 m-70 -102.86 -23.72 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.275 174.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.761 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 73.4 t -77.97 -63.8 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.729 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' HIS . . . . . 0.486 ' CD2' HG13 ' A' ' 120' ' ' ILE . 13.3 t60 . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 121.249 0.547 . . . . 0.0 110.324 -176.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.53 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.507 -0.688 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -89.41 67.72 2.31 Favored 'Trans proline' 0 N--CA 1.432 -2.132 0 C-N-CA 122.015 1.81 . . . . 0.0 111.177 175.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 52.7 tp -59.0 84.25 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.792 0.806 . . . . 0.0 110.781 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.438 ' H ' ' HG2' ' A' ' 112' ' ' MET . 15.5 ptt? -81.96 -55.95 4.27 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.86 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.9 m -162.09 118.72 2.06 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.564 ' O ' HG13 ' A' ' 118' ' ' ILE . 2.5 pm0 -57.47 -34.82 69.41 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -173.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 16.7 t70 -69.9 -42.6 73.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 109.946 -178.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.32 -37.26 80.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.292 175.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.568 HD21 HG23 ' A' ' 98' ' ' THR . 11.7 tp -61.89 -36.45 81.32 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.956 177.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 114' ' ' GLU . 61.8 mt -57.7 -47.4 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.436 174.081 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -67.14 -27.01 66.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 176.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.496 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -69.66 -38.49 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.695 175.319 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 1.03 HD13 ' HA ' ' A' ' 94' ' ' SER . 76.1 mt -74.78 -18.29 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.536 0.684 . . . . 0.0 109.806 176.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.665 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 4.5 m-20 -75.35 -42.41 54.27 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 166.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.4 -38.26 68.83 Favored Glycine 0 C--O 1.227 -0.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.037 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.769 HG23 ' HB2' ' A' ' 128' ' ' ASP . 7.5 p -59.34 -49.19 84.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 117.468 0.634 . . . . 0.0 109.765 176.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.5 mt -69.89 -8.39 48.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.221 0.534 . . . . 0.0 111.269 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.665 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 39.7 mmt-85 -100.56 -31.91 11.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.499 -179.498 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.36 -48.9 0.78 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.018 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.769 ' HB2' HG23 ' A' ' 124' ' ' VAL . 32.8 m-20 -65.96 -25.99 67.36 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.492 0.663 . . . . 0.0 110.137 -177.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.831 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -72.42 90.8 1.32 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.924 -1.034 . . . . 0.0 108.735 168.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.84 -29.8 50.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.523 -169.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -90.86 -6.05 54.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.333 0.587 . . . . 0.0 111.024 -177.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.831 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 89.1 m-20 55.95 49.46 15.8 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.353 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 p30 -95.22 -8.1 37.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.199 175.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 -1.3 85.49 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.45 177.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.591 ' HB2' HD12 ' A' ' 87' ' ' LEU . 24.1 m-85 -131.42 176.03 8.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 109.983 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.529 HD12 ' CG2' ' A' ' 124' ' ' VAL . 10.1 tt -112.09 118.7 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.796 0.808 . . . . 0.0 110.507 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -93.58 170.65 9.43 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.583 177.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.864 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.2 t80 -46.62 -54.94 8.46 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.061 0.544 . . . . 0.0 111.224 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.19 -25.88 68.54 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.021 0.439 . . . . 0.0 111.839 -176.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.535 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -77.81 -52.76 8.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.937 -175.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.864 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -72.64 -31.07 64.83 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.644 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.76 -40.54 79.98 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.889 0.376 . . . . 0.0 110.791 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -76.94 -29.25 55.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.333 177.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' SER . . . . . 0.412 ' HB3' HG13 ' A' ' 100' ' ' VAL . 22.7 t -82.8 -38.15 23.51 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.025 -170.251 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.838 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.662 -173.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.644 ' HB2' HD21 ' A' ' 72' ' ' LEU . 88.6 mmm . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.9 p -116.22 159.65 38.85 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 121.348 -0.141 . . . . 0.0 111.168 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.509 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 82.6 Cg_exo -49.33 -39.79 43.66 Favored 'Trans proline' 0 N--CA 1.481 0.741 0 C-N-CA 123.608 2.872 . . . . 0.0 115.511 -169.047 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.474 ' HA ' HE21 ' A' ' 73' ' ' GLN . 0.0 OUTLIER -57.56 -54.79 42.89 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 121.227 0.537 . . . . 0.0 110.648 -175.543 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -76.99 -27.17 54.62 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.886 177.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.644 HD21 ' HB2' ' A' ' 67' ' ' MET . 14.0 mt -65.57 -17.56 64.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 120.875 0.369 . . . . 0.0 111.502 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.54 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 44.4 mt-30 -71.23 -47.93 54.28 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 171.414 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.5 -22.49 63.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.016 172.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.555 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 22.8 t-80 -67.15 -37.07 83.15 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.329 176.292 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.539 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 3.8 m-30 -70.34 -34.62 72.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.483 0.659 . . . . 0.0 109.394 177.045 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.692 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 55.5 t80 -67.78 -52.3 38.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.913 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.692 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.2 mmmt -79.34 -14.81 58.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.381 -175.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.483 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.0 OUTLIER -45.33 -38.11 5.46 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 124.052 0.845 . . . . 0.0 111.816 -174.401 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.459 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -142.81 9.52 1.75 Allowed 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.713 178.955 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.502 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.7 t70 -85.21 79.51 9.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.863 0.84 . . . . 0.0 109.829 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 -11.22 24.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.7 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -90.14 -14.71 33.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.526 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.88 24.57 66.82 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.328 -0.851 . . . . 0.0 114.92 171.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -87.67 5.23 40.7 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.545 1.172 . . . . 0.0 111.012 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.542 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 11.3 m120 70.3 5.74 5.47 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.678 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.556 HD12 ' HB2' ' A' ' 135' ' ' TYR . 3.7 mm? -121.22 145.56 47.72 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.296 0.57 . . . . 0.0 109.932 175.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.487 ' HB3' ' HG ' ' A' ' 93' ' ' LEU . 3.6 mm? -107.44 110.71 22.73 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.149 174.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.588 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.4 p30 -84.64 -174.1 5.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.189 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.08 -47.43 66.94 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.093 0.397 . . . . 0.0 114.093 -176.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.658 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.8 pp -77.14 -28.16 54.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.599 0.699 . . . . 0.0 110.641 -175.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.658 ' N ' HD12 ' A' ' 91' ' ' LEU . 45.5 mt-10 -65.98 -55.08 18.57 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 172.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.939 ' HB3' HG12 ' A' ' 97' ' ' ILE . 32.7 mt -64.21 -12.58 42.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.198 -178.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.719 ' HA ' HD13 ' A' ' 121' ' ' ILE . 39.4 m -55.12 -34.13 63.45 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.595 0.236 . . . . 0.0 111.617 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -92.81 -31.49 15.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.19 0.519 . . . . 0.0 111.225 174.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.456 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . . . -80.04 -42.31 24.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.222 -170.416 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.939 HG12 ' HB3' ' A' ' 93' ' ' LEU . 41.2 mm -62.7 -25.2 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 111.055 -176.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.624 HG22 ' HB1' ' A' ' 109' ' ' ALA . 2.7 m -58.69 -18.61 32.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.58 176.32 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 72.9 m-70 -115.51 -33.47 5.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.369 172.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.873 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 39.1 t -58.91 -55.46 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 40.2 t60 . . . . . 0 C--O 1.234 0.247 0 CA-C-O 121.436 0.636 . . . . 0.0 110.348 -177.617 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.624 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.507 -0.698 0 N-CA-C 110.491 -0.189 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -74.48 61.38 5.2 Favored 'Trans proline' 0 N--CA 1.448 -1.203 0 C-N-CA 121.904 1.736 . . . . 0.0 110.848 172.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.8 tp -71.67 74.54 0.82 Allowed 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 122.185 0.993 . . . . 0.0 110.578 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.472 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.0 ptt? -75.61 -53.61 8.31 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.268 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.0 m -159.86 122.9 3.52 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 175.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.57 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -61.09 -33.97 74.2 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -170.179 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.61 -40.71 76.46 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.215 0.531 . . . . 0.0 110.37 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.0 tt0 -68.85 -36.69 78.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.848 0.832 . . . . 0.0 109.56 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.49 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.4 tm? -63.94 -36.81 85.17 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.612 177.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.57 HG13 ' O ' ' A' ' 114' ' ' GLU . 70.1 mt -62.52 -38.95 82.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.669 174.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -64.5 -40.45 95.67 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 174.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.64 -39.35 79.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.595 175.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.878 ' HA ' HG21 ' A' ' 97' ' ' ILE . 76.0 mt -59.85 -47.91 89.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.284 175.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.782 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 34.7 t70 -61.49 -39.89 92.58 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.66 -31.21 52.97 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.873 175.073 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.847 HG21 HD12 ' A' ' 97' ' ' ILE . 42.9 t -68.25 -49.22 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.291 -0.262 . . . . 0.0 110.291 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 134' ' ' GLY . 8.8 mp -63.63 -10.34 18.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.018 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.782 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 24.2 mtm-85 -102.31 -49.24 3.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -113.45 -45.1 3.15 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -172.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.609 ' HB2' HG13 ' A' ' 124' ' ' VAL . 10.1 m-20 -68.91 -24.09 64.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.898 0.38 . . . . 0.0 110.682 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.564 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.9 t70 -74.68 93.52 2.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.88 0.847 . . . . 0.0 108.962 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -79.08 -18.88 52.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.167 -172.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -2.35 43.9 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.202 -171.324 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.3 t30 60.64 32.91 20.4 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.389 -177.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -99.0 -1.98 38.45 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 121.061 0.458 . . . . 0.0 110.067 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.451 ' O ' ' HG ' ' A' ' 125' ' ' LEU . . . 82.02 -24.42 4.65 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.735 -0.666 . . . . 0.0 113.35 173.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.556 ' HB2' HD12 ' A' ' 87' ' ' LEU . 18.5 m-85 -116.48 -179.19 3.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.932 0.396 . . . . 0.0 110.59 -176.388 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.714 HG12 ' HG3' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -110.82 129.73 65.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.388 0.613 . . . . 0.0 112.091 179.206 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.474 ' H ' ' HG2' ' A' ' 140' ' ' GLU . 12.2 t70 -103.11 168.09 9.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.473 172.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.876 ' HA ' ' CE2' ' A' ' 141' ' ' PHE . 21.5 t80 -50.86 -44.05 59.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.718 0.294 . . . . 0.0 110.834 -177.607 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.443 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -67.81 -31.31 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -173.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.714 ' HG3' HG12 ' A' ' 136' ' ' ILE . 12.7 pt-20 -91.19 -30.06 16.88 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.508 -169.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.876 ' CE2' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -76.11 -32.06 58.99 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.21 171.533 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.405 ' N ' ' CD1' ' A' ' 141' ' ' PHE . . . -64.13 -43.02 96.57 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.407 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.0 mtmt -72.77 -28.78 62.81 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.351 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.3 t -70.04 -35.15 74.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.943 0.401 . . . . 0.0 110.274 -177.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.448 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.3 pp . . . . . 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.475 -177.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.823 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.2 mmm . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.718 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 26.6 m -98.4 139.4 21.15 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-O 120.997 0.427 . . . . 0.0 110.625 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.768 ' HA ' ' HB2' ' A' ' 72' ' ' LEU . 73.3 Cg_exo -50.92 -27.97 22.49 Favored 'Trans proline' 0 N--CA 1.477 0.51 0 C-N-CA 124.085 3.19 . . . . 0.0 115.15 -172.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -65.06 -51.32 62.18 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-O 120.731 0.301 . . . . 0.0 111.017 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.718 ' HG2' ' O ' ' A' ' 68' ' ' SER . 3.0 pm0 -72.33 -26.36 61.9 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.09 173.316 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.823 HD21 ' HB2' ' A' ' 67' ' ' MET . 39.5 mt -66.82 -17.5 64.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.688 0.28 . . . . 0.0 111.627 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 42.4 mt-30 -73.08 -40.97 64.58 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 171.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.2 tp -66.88 -21.88 65.99 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 171.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.582 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 5.0 t60 -66.91 -35.0 79.01 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.103 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.43 ' HD1' HG22 ' A' ' 100' ' ' VAL . 4.0 m-30 -72.1 -33.58 67.97 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.552 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 54.3 t80 -67.09 -53.08 34.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.154 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.552 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.9 mmmt -80.53 -11.12 59.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.596 -176.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.427 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 3.5 tpt -43.12 -43.41 4.47 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.069 0.856 . . . . 0.0 112.005 -172.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.539 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -141.06 10.06 2.14 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.88 179.332 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.745 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 34.2 t70 -82.07 80.7 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.31 0.576 . . . . 0.0 110.854 -176.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.539 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 3.9 m-85 -108.32 -6.11 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.738 178.066 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.5 p30 -75.8 -13.68 60.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.734 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.67 23.66 72.13 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 116.025 -0.534 . . . . 0.0 113.464 175.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -108.41 -8.65 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.616 0.708 . . . . 0.0 110.964 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.444 ' HB3' ' HZ ' ' A' ' 77' ' ' PHE . 81.7 m-20 64.41 20.58 12.21 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.564 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.49 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.9 mm? -127.89 157.04 41.6 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.667 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.609 ' HB2' HG22 ' A' ' 136' ' ' ILE . 83.2 mt -113.2 110.82 21.03 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.045 0.45 . . . . 0.0 111.537 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.524 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 8.0 t70 -83.31 161.45 21.42 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.565 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -44.59 -56.14 5.77 Favored Glycine 0 N--CA 1.464 0.514 0 N-CA-C 114.909 0.723 . . . . 0.0 114.909 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -73.55 -30.99 63.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.644 0.722 . . . . 0.0 111.262 -174.16 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.745 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.7 tt0 -69.61 -58.62 3.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.292 1.044 . . . . 0.0 108.768 176.236 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.951 ' HG ' HG12 ' A' ' 97' ' ' ILE . 40.7 tp -61.92 -10.44 9.5 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.755 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.849 ' HA ' HD13 ' A' ' 121' ' ' ILE . 18.8 m -51.94 -32.37 32.76 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.143 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.1 m -85.76 -27.34 25.28 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.531 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.826 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -85.17 -37.89 19.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -172.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.951 HG12 ' HG ' ' A' ' 93' ' ' LEU . 46.1 mm -64.3 -21.76 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 CA-C-O 120.902 0.382 . . . . 0.0 111.037 -177.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.647 HG22 ' HB1' ' A' ' 109' ' ' ALA . 4.2 m -57.58 -31.09 65.81 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.972 174.508 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.552 ' ND1' ' HB2' ' A' ' 109' ' ' ALA . 98.7 m-70 -101.42 -32.97 10.18 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.555 176.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.828 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 36.7 t -56.89 -52.42 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.486 0.184 . . . . 0.0 110.875 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 . . . . . 0 C--O 1.232 0.183 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.216 171.83 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.647 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.502 -0.878 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -83.04 67.1 7.79 Favored 'Trans proline' 0 N--CA 1.436 -1.862 0 C-N-CA 121.555 1.503 . . . . 0.0 111.305 175.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.22 79.61 0.05 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.368 1.08 . . . . 0.0 109.852 173.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.447 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.0 ptt? -92.15 -58.35 2.42 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 113.631 -1.622 . . . . 0.0 110.436 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.6 m -161.02 120.95 2.68 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.49 ' O ' HG13 ' A' ' 118' ' ' ILE . 9.2 pt-20 -56.39 -27.03 55.11 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -174.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.84 -47.18 78.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.375 0.607 . . . . 0.0 110.12 176.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.19 -38.8 85.97 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -60.65 -38.69 85.69 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.355 178.771 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 114' ' ' GLU . 30.9 mt -59.39 -50.62 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.517 174.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.2 -33.01 74.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.132 0.491 . . . . 0.0 110.357 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.2 mp -63.73 -45.68 96.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.01 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.857 ' HA ' HG21 ' A' ' 97' ' ' ILE . 71.7 mt -62.94 -44.94 99.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 121.141 0.496 . . . . 0.0 109.705 176.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.758 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.7 t70 -57.55 -44.55 85.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.429 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.46 -31.77 60.28 Favored Glycine 0 C--N 1.334 0.453 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.448 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.916 HG21 HD12 ' A' ' 97' ' ' ILE . 44.5 t -63.39 -51.62 68.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.271 173.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.62 -6.82 22.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.275 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.758 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 19.7 mtm180 -101.64 -47.77 4.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.045 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -115.56 -44.88 2.93 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.504 ' HB2' HG13 ' A' ' 124' ' ' VAL . 17.4 m-20 -70.96 -22.06 62.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.025 0.44 . . . . 0.0 111.049 -177.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -80.12 84.34 5.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -71.55 -26.65 62.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.756 -174.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ASN . . . . . 0.476 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.6 m120 -76.45 -14.72 60.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.305 -173.065 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.7 t30 63.41 25.94 14.75 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.663 0.744 . . . . 0.0 109.221 -175.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -92.47 -15.0 27.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.837 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.5 -25.34 28.43 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.9 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.524 ' CD2' ' HA ' ' A' ' 89' ' ' ASP . 14.2 m-85 -116.42 162.79 17.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.176 -176.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.609 HG22 ' HB2' ' A' ' 88' ' ' LEU . 7.3 tt -96.65 130.89 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.465 0.65 . . . . 0.0 110.263 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -103.02 172.03 7.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.53 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.812 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 11.2 t80 -53.25 -48.03 68.57 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 123.135 0.272 . . . . 0.0 110.752 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -64.44 -31.21 72.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.485 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -75.87 -52.43 10.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.573 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.812 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.0 p90 -70.16 -28.05 65.02 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.397 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.57 -40.37 96.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 120.941 0.401 . . . . 0.0 110.447 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.8 mtmt -74.14 -28.81 61.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.762 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 13.7 t -80.94 -33.86 33.72 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.97 -174.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.0 pp . . . . . 0 CA--C 1.533 0.3 0 O-C-N 122.336 -0.228 . . . . 0.0 111.502 -178.222 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.504 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 91.7 mmm . . . . . 0 N--CA 1.464 0.256 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.495 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -93.9 161.34 30.28 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.543 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 10.1 Cg_endo -52.29 -46.62 31.64 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.145 2.563 . . . . 0.0 113.82 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -61.63 -50.28 73.17 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.252 -172.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.437 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 7.8 pm0 -71.97 -28.94 63.76 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.398 176.42 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.507 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 13.0 mt -66.76 -21.13 66.07 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.3 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.55 ' HG2' HD12 ' A' ' 145' ' ' LEU . 96.3 mt-30 -69.35 -46.46 66.95 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 173.706 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.47 -21.93 66.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.757 172.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.507 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 11.0 t-80 -69.99 -44.29 69.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.175 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.597 ' HE2' ' CD2' ' A' ' 145' ' ' LEU . 5.3 m-30 -67.58 -26.82 66.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.527 0.68 . . . . 0.0 109.371 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.641 ' HA ' HD11 ' A' ' 88' ' ' LEU . 48.6 t80 -74.87 -52.61 10.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 114.526 -1.215 . . . . 0.0 109.989 179.182 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.549 ' HA ' ' HE3' ' A' ' 78' ' ' LYS . 19.7 mmmt -81.15 -24.63 37.44 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -174.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 18.2 tpp -44.84 -46.06 10.53 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -172.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.89 ' CE1' HD22 ' A' ' 88' ' ' LEU . 1.8 p80 -130.26 8.28 5.08 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.578 -169.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.645 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 29.3 t70 -84.49 64.84 8.64 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.961 0.886 . . . . 0.0 109.357 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -95.66 3.29 54.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.627 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -89.27 -14.24 36.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.14 26.63 71.84 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.557 -0.747 . . . . 0.0 113.85 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -109.03 -1.74 18.68 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.714 0.757 . . . . 0.0 112.259 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 67.99 14.31 9.32 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.365 0.416 . . . . 0.0 111.512 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.536 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.8 mm? -126.35 155.25 42.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.89 HD22 ' CE1' ' A' ' 80' ' ' HIS . 17.8 mt -111.69 113.63 26.12 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.201 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.27 176.12 6.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.546 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.03 -51.88 47.03 Favored Glycine 0 CA--C 1.518 0.223 0 N-CA-C 114.238 0.455 . . . . 0.0 114.238 -178.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.611 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.0 pp -73.81 -26.28 60.53 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.359 0.579 . . . . 0.0 110.77 -173.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.645 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 46.9 mt-10 -65.0 -54.8 24.69 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 122.112 0.958 . . . . 0.0 108.509 168.163 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.88 ' HB3' HG12 ' A' ' 97' ' ' ILE . 57.1 mt -60.46 -10.04 4.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.077 -1.419 . . . . 0.0 112.53 -175.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.68 ' HA ' HD13 ' A' ' 121' ' ' ILE . 85.0 p -51.49 -33.08 29.93 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.54 0.525 . . . . 0.0 111.55 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -90.26 -33.33 16.18 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -93.96 -32.21 13.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -168.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.881 HD12 HG21 ' A' ' 124' ' ' VAL . 35.3 mm -65.4 -23.18 32.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.267 0.556 . . . . 0.0 110.445 -177.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.769 HG23 HD21 ' A' ' 117' ' ' LEU . 13.4 m -60.07 -17.84 42.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.9 174.422 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -110.59 -38.3 5.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.032 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.767 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 54.9 t -56.85 -59.53 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.116 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' HIS . . . . . 0.431 ' CD2' HG13 ' A' ' 120' ' ' ILE . 7.7 t60 . . . . . 0 N--CA 1.449 -0.499 0 CA-C-O 121.401 0.62 . . . . 0.0 109.423 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.44 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.508 -0.639 0 CA-C-O 120.506 0.193 . . . . 0.0 111.002 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 11.8 Cg_endo -91.38 69.37 1.1 Allowed 'Trans proline' 0 N--CA 1.435 -1.921 0 C-N-CA 122.231 1.954 . . . . 0.0 111.678 175.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.8 mt -51.1 93.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.669 0.747 . . . . 0.0 110.967 173.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -100.82 -55.29 2.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.623 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.7 m -160.74 118.28 2.43 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.489 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.7 OUTLIER -55.41 -36.64 66.67 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -174.541 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -67.57 -49.67 62.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.108 0.48 . . . . 0.0 110.154 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.28 -36.93 74.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.202 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.769 HD21 HG23 ' A' ' 98' ' ' THR . 9.8 tp -66.44 -41.09 89.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.323 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.2 mt -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.392 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -70.77 -31.47 68.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.431 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.431 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.0 OUTLIER -62.02 -38.54 81.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.273 175.911 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.874 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -64.08 -41.6 92.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.914 176.276 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.705 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.1 t70 -62.3 -44.1 97.3 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.613 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.91 -30.24 56.65 Favored Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.492 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.881 HG21 HD12 ' A' ' 97' ' ' ILE . 42.7 t -63.67 -50.49 77.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.996 0.427 . . . . 0.0 110.362 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.27 -6.25 22.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.051 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.705 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 27.8 mtm-85 -98.88 -48.47 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.055 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -121.27 -39.65 2.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.537 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 21.6 m-20 -67.48 -21.89 65.49 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.031 0.443 . . . . 0.0 110.967 -178.106 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.525 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.7 t70 -76.1 92.64 3.23 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 166.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -78.96 -27.69 43.58 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.471 -168.546 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.51 4.84 36.34 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.974 -170.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.525 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 65.0 t30 57.35 53.29 7.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.133 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -108.49 -3.86 17.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.773 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.15 -18.9 37.92 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.94 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.536 ' HB2' HD12 ' A' ' 87' ' ' LEU . 48.8 m-85 -117.36 177.34 4.77 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.878 0.37 . . . . 0.0 110.025 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.573 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.3 tt -113.38 123.52 69.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.403 0.62 . . . . 0.0 109.492 174.466 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -101.62 -179.34 3.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.836 177.245 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.872 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 9.4 t80 -52.2 -51.19 59.65 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.579 0.549 . . . . 0.0 111.476 -173.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.54 -22.04 64.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -175.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.468 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 52.6 mt-10 -80.08 -50.8 9.83 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -174.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.872 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 5.0 p90 -71.44 -33.59 69.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.84 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.12 77.16 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.848 0.356 . . . . 0.0 110.821 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -73.08 -29.22 62.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.111 176.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 7.7 t -81.14 -18.9 44.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -174.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.758 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 91.3 mt . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.989 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.701 ' HB2' ' CD1' ' A' ' 72' ' ' LEU . 85.6 mmm . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.8 m -96.69 153.45 38.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.166 177.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -49.36 -43.1 39.28 Favored 'Trans proline' 0 N--CA 1.479 0.657 0 C-N-CA 122.931 2.421 . . . . 0.0 113.573 -173.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -56.72 -44.87 82.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.055 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 2.0 mm-40 -64.93 -43.8 91.58 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.279 174.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.701 ' CD1' ' HB2' ' A' ' 67' ' ' MET . 7.7 mp -57.2 -24.8 56.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -169.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.61 ' HG2' HD21 ' A' ' 145' ' ' LEU . 66.4 mt-30 -63.9 -50.42 68.81 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 173.473 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 34.2 tp -63.49 -24.07 67.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.011 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.579 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 13.7 t60 -66.62 -38.25 86.54 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 4.3 m-30 -71.92 -37.02 70.13 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.283 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.66 ' HA ' HD11 ' A' ' 88' ' ' LEU . 48.7 t80 -62.16 -52.75 62.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.943 178.476 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -80.24 -13.66 59.05 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.57 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.63 -45.83 9.8 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 124.044 0.84 . . . . 0.0 111.069 -171.246 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.485 ' CD2' ' HE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -139.54 9.97 2.46 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.966 -178.634 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.75 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 26.2 t70 -85.07 82.96 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.892 0.853 . . . . 0.0 109.758 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.485 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.7 OUTLIER -121.63 15.17 11.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.144 -177.254 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -95.12 -13.33 25.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.219 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 12.14 80.59 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.249 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -98.34 -4.15 35.55 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 117.394 0.597 . . . . 0.0 111.065 -178.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 58.38 34.4 23.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.605 176.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.451 HD22 ' HB2' ' A' ' 135' ' ' TYR . 7.9 mt -151.54 149.37 29.12 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.563 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.66 HD11 ' HA ' ' A' ' 77' ' ' PHE . 68.8 mt -94.81 113.21 24.94 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.973 0.416 . . . . 0.0 111.823 -177.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.485 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 8.9 t70 -91.71 167.0 12.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.391 177.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.86 -49.93 39.82 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.66 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -68.92 -29.22 67.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 117.413 0.606 . . . . 0.0 110.631 -176.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.75 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 50.8 mt-10 -69.83 -48.54 58.58 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.826 ' HB3' HG12 ' A' ' 97' ' ' ILE . 25.2 mt -65.26 -11.24 39.3 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.31 -178.427 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.672 ' HA ' HD13 ' A' ' 121' ' ' ILE . 65.9 m -58.46 -33.35 69.65 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.832 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -93.35 -27.67 16.63 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.217 0.532 . . . . 0.0 111.482 174.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . . . -86.51 -41.43 14.36 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -169.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.899 HG21 ' HA ' ' A' ' 121' ' ' ILE . 43.0 mm -64.43 -21.13 28.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.012 0.434 . . . . 0.0 110.692 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.717 HG22 ' HB1' ' A' ' 109' ' ' ALA . 2.6 m -58.12 -21.95 48.83 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.54 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 80.6 m-70 -115.16 -6.2 12.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.322 176.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.736 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 42.0 t -90.13 -46.39 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 120.771 0.32 . . . . 0.0 111.432 -179.987 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.717 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.512 -0.513 0 CA-C-O 120.343 0.116 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.78 72.56 6.46 Favored 'Trans proline' 0 N--CA 1.444 -1.42 0 C-N-CA 122.083 1.855 . . . . 0.0 111.795 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.23 80.44 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.921 0.867 . . . . 0.0 110.383 169.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.424 ' H ' ' HG2' ' A' ' 112' ' ' MET . 15.1 ptt? -98.94 -60.51 1.52 Allowed 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.668 -178.137 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.8 m -165.6 120.19 1.24 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.07 -35.29 66.8 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -172.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.2 -46.79 88.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.217 0.532 . . . . 0.0 110.544 179.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.03 -33.65 63.83 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.115 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.67 HD21 HG23 ' A' ' 98' ' ' THR . 17.0 tp -61.25 -39.01 88.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.998 175.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 51.3 mt -61.38 -44.01 97.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.129 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -68.27 -33.13 73.79 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.395 0.617 . . . . 0.0 110.331 176.042 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.48 -40.53 84.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.416 174.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.899 ' HA ' HG21 ' A' ' 97' ' ' ILE . 90.3 mt -61.79 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.146 177.0 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.76 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.7 t70 -58.7 -44.43 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.556 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.87 -33.89 50.59 Favored Glycine 0 C--N 1.332 0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.184 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.821 HG21 HD12 ' A' ' 97' ' ' ILE . 39.8 t -63.0 -53.84 41.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.582 0.23 . . . . 0.0 110.872 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.536 HD11 HD12 ' A' ' 93' ' ' LEU . 9.0 mp -63.95 -14.52 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.967 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.76 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.4 mtm180 -95.0 -50.14 5.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.251 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -117.7 -41.3 2.94 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -170.191 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.511 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -68.1 -18.79 64.75 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.523 0.678 . . . . 0.0 109.669 178.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.642 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 3.2 t70 -72.34 90.68 1.29 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.693 165.413 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -79.51 -16.85 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.276 -170.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -113.4 13.36 18.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -171.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.8 t30 53.8 50.11 17.67 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.27 173.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -110.9 -9.02 14.46 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.553 -0.459 . . . . 0.0 109.997 173.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 79.72 0.78 85.68 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.524 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.451 ' HB2' HD22 ' A' ' 87' ' ' LEU . 87.2 m-85 -126.08 175.35 7.81 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.593 HG22 ' HB2' ' A' ' 88' ' ' LEU . 10.2 tt -118.56 121.11 66.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.421 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -99.92 -176.87 3.37 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.308 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.847 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.2 t80 -53.41 -50.2 65.69 Favored 'General case' 0 C--O 1.225 -0.227 0 O-C-N 123.66 0.6 . . . . 0.0 111.812 -173.622 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.79 -35.14 78.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.768 0.318 . . . . 0.0 110.756 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.642 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 48.9 mt-10 -66.21 -53.79 32.94 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.815 -174.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.847 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -73.08 -32.03 64.74 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.798 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.61 97.73 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.124 0.487 . . . . 0.0 110.117 178.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -70.09 -29.03 65.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.927 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 9.6 t -82.45 -32.78 28.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.608 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.61 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.5 pp . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 121.205 0.526 . . . . 0.0 111.065 -179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.649 ' HB2' HD21 ' A' ' 72' ' ' LEU . 97.7 mmm . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 110.45 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.48 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 49.1 m -97.79 161.96 23.95 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.324 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.525 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.8 Cg_exo -50.83 -46.48 30.18 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.94 2.426 . . . . 0.0 114.57 -172.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -59.6 -49.23 78.55 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.48 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 1.6 pm0 -78.35 -26.13 46.6 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 122.048 -0.407 . . . . 0.0 111.121 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.649 HD21 ' HB2' ' A' ' 67' ' ' MET . 11.8 mt -64.41 -20.02 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.533 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 29.6 mt-30 -73.35 -43.04 61.51 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 51.5 tp -65.61 -23.82 66.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.715 173.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.515 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 46.3 t60 -64.3 -37.29 86.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 176.078 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.461 ' HD1' HG22 ' A' ' 100' ' ' VAL . 4.2 m-30 -69.26 -35.31 75.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.629 177.666 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.574 ' HD1' ' HE2' ' A' ' 141' ' ' PHE . 62.9 t80 -68.72 -50.33 51.67 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.514 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -80.05 -13.71 59.1 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.361 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -45.06 -41.29 7.49 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.94 0.775 . . . . 0.0 112.937 -172.035 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.586 ' HB3' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -141.49 10.52 2.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.904 -178.052 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.677 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 23.5 t70 -82.83 81.93 8.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.823 0.82 . . . . 0.0 109.681 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.56 15.62 18.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.723 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.0 p30 -99.69 -13.14 19.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.88 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 71.2 29.42 68.63 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.021 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -106.83 -3.58 20.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.477 0.638 . . . . 0.0 111.342 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 60.65 42.42 13.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.586 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.497 HD22 ' HB2' ' A' ' 135' ' ' TYR . 6.0 mt -158.3 153.56 25.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.419 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.582 ' HB2' HG22 ' A' ' 136' ' ' ILE . 96.4 mt -106.15 113.34 26.82 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.912 0.387 . . . . 0.0 111.29 178.207 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.516 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 16.8 t70 -87.33 157.57 19.25 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.744 172.185 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -46.93 -35.74 8.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.671 -177.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.516 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 36.0 mt -65.42 -40.71 93.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.975 0.417 . . . . 0.0 111.656 -178.066 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.677 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 27.9 mt-10 -74.6 -44.22 51.79 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.549 1.166 . . . . 0.0 108.82 172.555 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.931 ' HG ' HG12 ' A' ' 97' ' ' ILE . 10.7 tp -63.77 -12.97 39.81 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 113.286 -1.779 . . . . 0.0 111.917 -169.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.885 ' HA ' HD13 ' A' ' 121' ' ' ILE . 40.9 p -51.82 -48.77 63.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.419 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -78.29 -26.94 47.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.205 0.526 . . . . 0.0 111.397 -176.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.62 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -80.98 -42.5 21.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.657 -173.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.931 HG12 ' HG ' ' A' ' 93' ' ' LEU . 45.1 mm -66.05 -17.41 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.043 0.449 . . . . 0.0 111.151 -177.303 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.632 HG23 HD21 ' A' ' 117' ' ' LEU . 2.0 m -63.69 -15.13 57.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 175.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -115.58 -32.98 5.37 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.449 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.789 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.3 t -59.86 -53.78 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.77 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 32.6 t-80 . . . . . 0 C--O 1.234 0.241 0 CA-C-O 121.001 0.429 . . . . 0.0 110.499 178.479 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.578 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.509 -0.625 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' PRO . . . . . 0.419 ' O ' ' HG2' ' A' ' 112' ' ' MET . 7.4 Cg_exo -73.29 60.31 3.97 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.364 2.043 . . . . 0.0 111.68 177.058 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.66 77.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.114 0.959 . . . . 0.0 110.979 174.128 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 110' ' ' PRO . 8.0 ptt? -95.44 -59.1 1.95 Allowed 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.718 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.418 ' H ' ' HG3' ' A' ' 112' ' ' MET . 40.3 m -160.59 118.58 2.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.499 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.0 pt-20 -52.54 -37.02 56.79 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -172.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -66.3 -42.05 88.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.979 0.418 . . . . 0.0 110.471 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -75.35 -29.06 59.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.315 178.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.632 HD21 HG23 ' A' ' 98' ' ' THR . 13.8 tp -65.0 -38.54 91.3 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 173.648 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 114' ' ' GLU . 90.6 mt -62.07 -43.1 97.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.249 172.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -63.43 -34.96 78.88 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.084 0.469 . . . . 0.0 110.407 175.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -39.56 85.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.38 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.885 HD13 ' HA ' ' A' ' 94' ' ' SER . 78.5 mt -66.27 -41.78 89.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.429 0.633 . . . . 0.0 109.865 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.795 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 29.6 t70 -62.33 -44.25 96.92 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.666 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLY . . . . . 0.489 ' HA2' ' HD3' ' A' ' 126' ' ' ARG . . . -54.3 -34.37 53.86 Favored Glycine 0 C--N 1.334 0.46 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.998 176.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.923 HG21 HD12 ' A' ' 97' ' ' ILE . 39.0 t -59.07 -53.41 48.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.886 0.375 . . . . 0.0 110.196 172.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 62.7 mt -68.46 -0.77 5.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.618 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.795 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.9 mtp180 -103.43 -47.98 4.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.681 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -121.38 -38.23 2.81 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -173.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.538 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -75.77 -16.49 60.12 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.192 0.52 . . . . 0.0 110.805 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.604 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.5 t70 -78.9 87.24 4.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 169.249 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -74.88 -32.79 61.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.139 -168.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.98 -3.09 58.95 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.609 -176.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.604 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 18.7 m120 60.71 43.24 12.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.018 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.1 p30 -98.17 -12.58 21.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.358 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.68 4.29 89.05 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.335 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.497 ' HB2' HD22 ' A' ' 87' ' ' LEU . 59.2 m-85 -129.56 -179.85 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 175.219 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.582 HG22 ' HB2' ' A' ' 88' ' ' LEU . 8.9 tt -120.81 120.74 63.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.43 0.633 . . . . 0.0 110.142 174.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -97.22 -178.09 4.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.823 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 21.5 t80 -55.21 -49.04 72.97 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.413 0.446 . . . . 0.0 111.669 -172.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.64 -31.49 71.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.489 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.55 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.7 mt-10 -68.69 -51.26 43.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.404 -176.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.823 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.8 p90 -74.98 -32.48 61.69 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.734 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -61.08 -45.45 94.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.956 0.408 . . . . 0.0 110.074 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -65.62 -30.15 70.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.22 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 8.0 t -82.67 -37.01 25.43 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.831 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 3.8 pp . . . . . 0 N--CA 1.463 0.217 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.206 -176.431 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.618 ' HE1' ' HA ' ' A' ' 72' ' ' LEU . 51.8 mtp . . . . . 0 CA--C 1.52 -0.177 0 CA-C-O 121.057 0.455 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 3.9 m -91.44 152.91 44.11 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.738 177.005 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.58 -49.05 18.8 Favored 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.237 1.958 . . . . 0.0 113.698 -176.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -60.42 -41.02 93.1 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.451 -175.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 68' ' ' SER . 12.9 pt-20 -75.74 -33.94 60.28 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.751 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.635 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -64.95 -21.68 66.87 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.329 0.585 . . . . 0.0 111.309 -174.532 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.49 ' HG2' HD21 ' A' ' 145' ' ' LEU . 45.7 mt-30 -73.09 -43.47 61.76 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 175.256 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.59 -20.86 66.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.911 172.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.635 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 13.0 t-80 -64.65 -44.1 91.51 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 120.856 0.36 . . . . 0.0 110.348 175.242 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.74 ' CD1' HG22 ' A' ' 100' ' ' VAL . 3.8 m-30 -66.34 -25.97 67.07 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.24 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.759 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.6 t80 -74.17 -53.75 9.2 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.297 177.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.759 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.4 mmmt -80.63 -12.72 59.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.331 -173.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.466 ' HG2' ' HA ' ' A' ' 96' ' ' ALA . 1.0 OUTLIER -45.51 -35.69 4.03 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.981 0.801 . . . . 0.0 112.244 -174.149 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.79 10.58 1.06 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.575 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 30.1 t70 -84.55 81.71 8.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.909 0.861 . . . . 0.0 110.337 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -99.31 -6.88 27.16 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.286 177.386 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -95.8 -14.52 23.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.614 -174.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 66.37 23.96 72.01 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 114.911 0.724 . . . . 0.0 114.911 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -84.47 3.54 35.84 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.299 1.049 . . . . 0.0 111.026 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.621 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 29.2 m-80 59.52 28.0 17.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.531 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.0 mt -148.99 167.45 25.77 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.958 177.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.534 ' HB2' HG22 ' A' ' 136' ' ' ILE . 13.0 mt -135.26 122.08 21.04 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.201 -179.312 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -103.67 -170.52 1.79 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -51.21 -38.67 40.85 Favored Glycine 0 CA--C 1.521 0.468 0 O-C-N 123.399 0.437 . . . . 0.0 113.978 -174.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.2 mt -67.75 -41.25 83.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.354 0.597 . . . . 0.0 111.09 -175.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.575 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 40.1 mt-10 -74.69 -45.79 42.05 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.624 0.726 . . . . 0.0 109.886 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.572 ' HB3' HG12 ' A' ' 97' ' ' ILE . 21.7 mt -63.92 -20.36 65.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.98 -1.009 . . . . 0.0 113.148 -172.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.769 ' HA ' HD13 ' A' ' 121' ' ' ILE . 53.4 p -53.53 -36.7 62.08 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.735 0.302 . . . . 0.0 111.624 -177.607 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -90.04 -33.4 16.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 0.0 111.141 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.598 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.16 -47.47 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.738 -171.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.879 HD12 HG21 ' A' ' 124' ' ' VAL . 36.5 mm -59.44 -22.75 23.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.612 -174.221 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.835 HG23 HD21 ' A' ' 117' ' ' LEU . 18.5 m -58.88 -18.24 31.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.308 175.648 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 47.7 m80 -113.96 -17.27 12.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.403 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.74 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.4 t -88.27 -51.6 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.138 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' HIS . . . . . 0.504 ' CD2' HG13 ' A' ' 120' ' ' ILE . 52.7 t60 . . . . . 0 C--N 1.332 -0.194 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.861 -177.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.624 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -83.11 64.36 7.86 Favored 'Trans proline' 0 N--CA 1.439 -1.72 0 C-N-CA 122.03 1.82 . . . . 0.0 110.874 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 46.8 tp -63.08 81.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 122.002 0.906 . . . . 0.0 111.054 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.417 ' H ' ' HG2' ' A' ' 112' ' ' MET . 8.9 ptt? -89.62 -56.09 3.39 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.366 178.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.6 m -159.8 123.57 3.7 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 177.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.577 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.51 -40.86 65.74 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.742 -172.505 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 34.1 t70 -71.12 -39.88 71.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -67.48 -37.15 82.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.355 0.598 . . . . 0.0 109.597 174.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.835 HD21 HG23 ' A' ' 98' ' ' THR . 11.9 tp -61.86 -32.87 73.26 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.048 177.072 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.577 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.7 mt -62.78 -43.96 99.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.416 174.109 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ASN . . . . . 0.508 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 16.6 m120 -69.02 -24.17 64.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.183 0.516 . . . . 0.0 110.607 176.16 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.504 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -66.07 -39.0 83.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.575 0.702 . . . . 0.0 109.505 173.255 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.789 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -68.5 -38.76 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.379 174.758 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.611 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 94.4 m-20 -53.41 -49.55 67.04 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.732 172.041 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.81 -34.23 36.76 Favored Glycine 0 CA--C 1.508 -0.354 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.981 178.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.879 HG21 HD12 ' A' ' 97' ' ' ILE . 76.7 t -68.0 -51.78 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-O 120.801 0.334 . . . . 0.0 110.939 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.426 HD21 HD12 ' A' ' 93' ' ' LEU . 54.6 mt -67.72 -11.47 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.948 -177.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.611 ' NH1' ' HB3' ' A' ' 122' ' ' ASP . 48.8 mtt180 -105.64 -32.18 8.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.5 -177.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -132.18 -44.62 0.94 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -171.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.572 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 39.7 m-20 -71.62 -19.72 62.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.693 0.282 . . . . 0.0 111.468 -176.257 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.534 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -77.06 99.72 5.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 167.422 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -80.87 -19.08 45.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.904 -170.208 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 -3.65 29.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.549 -171.021 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 66.68 33.06 6.59 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.427 0.454 . . . . 0.0 111.376 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -97.08 -8.77 29.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.108 0.48 . . . . 0.0 110.056 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLY . . . . . 0.413 ' C ' ' HD2' ' A' ' 135' ' ' TYR . . . 79.97 -8.56 50.3 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.946 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.413 ' HD2' ' C ' ' A' ' 134' ' ' GLY . 5.3 m-30 -115.58 167.09 11.21 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.563 HG22 HD21 ' A' ' 93' ' ' LEU . 8.1 tt -111.76 118.2 57.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.792 0.806 . . . . 0.0 110.436 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -88.13 168.84 12.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.067 177.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.819 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.0 t80 -50.43 -47.67 56.57 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 123.084 0.24 . . . . 0.0 110.406 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.16 75.15 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 120.757 0.313 . . . . 0.0 111.379 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.534 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 45.3 mt-10 -68.68 -54.86 13.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.444 -176.336 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.819 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -70.72 -30.54 67.1 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.49 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.471 ' O ' ' HG ' ' A' ' 145' ' ' LEU . . . -61.69 -50.23 73.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 176.684 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -63.82 -32.39 73.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.099 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 15.9 t -77.7 -28.59 51.05 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.385 -177.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.49 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp . . . . . 0 CA--C 1.53 0.194 0 O-C-N 122.412 -0.18 . . . . 0.0 111.107 -179.374 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.67 ' HB2' HD21 ' A' ' 72' ' ' LEU . 89.6 mmm . . . . . 0 N--CA 1.461 0.115 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.503 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -88.43 153.09 50.59 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.297 0.094 . . . . 0.0 111.196 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.89 -44.02 43.94 Favored 'Trans proline' 0 N--CA 1.476 0.492 0 C-N-CA 123.307 2.671 . . . . 0.0 114.701 -170.331 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -59.48 -49.06 79.23 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.741 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -74.5 -26.27 59.9 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.586 175.937 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.67 HD21 ' HB2' ' A' ' 67' ' ' MET . 17.2 mt -63.34 -18.89 64.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.405 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 88.8 mt-30 -71.71 -45.43 61.85 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.707 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.43 -21.02 66.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.566 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.581 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 7.2 t-80 -66.9 -40.31 87.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.106 177.288 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.615 ' HE2' HD21 ' A' ' 145' ' ' LEU . 5.9 m-30 -68.39 -32.99 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.545 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 57.3 t80 -71.02 -51.17 26.94 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.296 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -80.56 -16.91 53.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.868 -175.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.0 tpp -44.35 -48.69 9.72 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.646 0.591 . . . . 0.0 112.404 -172.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.575 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -130.68 10.22 5.11 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.88 -175.584 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.726 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 26.5 t70 -80.47 75.15 7.33 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.68 0.752 . . . . 0.0 110.005 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -91.53 -15.27 28.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.122 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.6 p30 -76.41 -14.24 60.08 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 -177.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.82 30.57 77.49 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.483 -0.78 . . . . 0.0 113.065 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -101.36 3.45 40.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 117.294 0.547 . . . . 0.0 111.229 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 64.15 34.51 10.98 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.335 0.588 . . . . 0.0 110.479 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.509 ' HB3' ' CD2' ' A' ' 135' ' ' TYR . 15.6 mt -157.23 158.33 35.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.88 178.429 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.526 HD11 ' HA ' ' A' ' 77' ' ' PHE . 88.3 mt -120.15 121.43 38.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.82 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.464 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 0.6 OUTLIER -92.24 -177.45 4.66 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.399 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -55.85 -37.09 68.36 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.295 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.464 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 26.0 mt -68.66 -47.75 65.73 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.141 0.496 . . . . 0.0 110.368 -177.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.726 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 45.2 mt-10 -64.11 -42.23 96.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.87 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.634 HD21 HG22 ' A' ' 136' ' ' ILE . 24.1 mt -66.55 -18.39 65.34 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.792 -175.617 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.639 ' HA ' HD13 ' A' ' 121' ' ' ILE . 46.4 t -57.1 -32.06 65.91 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.689 0.28 . . . . 0.0 111.048 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.88 -31.01 15.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.069 0.461 . . . . 0.0 111.188 178.149 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.57 -43.73 12.46 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.867 HD12 HG21 ' A' ' 124' ' ' VAL . 39.7 mm -64.77 -25.91 38.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -175.747 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.618 HG22 ' HB1' ' A' ' 109' ' ' ALA . 17.9 m -58.47 -20.27 43.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.724 174.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 31.4 m80 -109.44 -27.07 9.66 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 173.651 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.768 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 38.4 t -67.48 -58.66 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.719 0.295 . . . . 0.0 111.173 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 . . . . . 0 N--CA 1.452 -0.325 0 CA-C-O 121.364 0.602 . . . . 0.0 110.026 -177.831 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.618 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.505 -0.762 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 3.7 Cg_exo -78.19 65.99 8.37 Favored 'Trans proline' 0 N--CA 1.443 -1.486 0 C-N-CA 121.745 1.63 . . . . 0.0 111.228 177.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.62 81.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.864 0.84 . . . . 0.0 111.095 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.409 ' CG ' ' H ' ' A' ' 113' ' ' SER . 14.4 ptt? -98.23 -57.81 2.12 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.005 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.409 ' H ' ' CG ' ' A' ' 112' ' ' MET . 73.6 m -162.39 124.58 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.516 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.25 -37.88 65.18 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.132 -173.939 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.78 -43.93 82.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.026 0.441 . . . . 0.0 110.662 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.08 -39.73 86.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.344 0.592 . . . . 0.0 109.932 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.574 HD13 HG23 ' A' ' 98' ' ' THR . 10.8 mt -62.66 -37.67 87.33 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.99 175.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 114' ' ' GLU . 63.6 mt -60.82 -42.98 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.032 0.444 . . . . 0.0 110.619 172.455 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -67.36 -29.81 69.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.222 0.534 . . . . 0.0 110.479 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.44 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.0 OUTLIER -65.57 -34.49 70.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.885 174.656 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.852 ' HA ' HG21 ' A' ' 97' ' ' ILE . 88.4 mt -67.26 -38.34 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.8 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.805 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.9 t70 -60.79 -46.0 92.21 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.232 176.342 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.56 -37.75 41.91 Favored Glycine 0 C--N 1.334 0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.007 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 54.8 t -63.58 -51.04 75.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 110.417 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.8 mt -65.02 -7.48 12.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.45 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.805 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 13.6 mtm180 -106.42 -49.33 3.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.847 0.356 . . . . 0.0 110.791 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -113.13 -44.19 3.29 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -169.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.51 ' HB2' HG13 ' A' ' 124' ' ' VAL . 27.3 m-20 -71.8 -23.89 61.64 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.151 0.5 . . . . 0.0 110.028 -177.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.607 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 4.6 t70 -76.05 88.22 2.98 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 168.006 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.5 -21.51 57.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.477 -169.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -108.14 6.46 26.85 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.168 -170.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.459 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 44.1 m-80 58.41 38.96 25.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 175.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.9 p30 -96.74 -13.27 22.8 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.308 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.18 2.69 90.45 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.312 178.101 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.509 ' CD2' ' HB3' ' A' ' 87' ' ' LEU . 28.5 m-85 -124.7 173.43 8.55 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.634 HG22 HD21 ' A' ' 93' ' ' LEU . 6.7 tt -116.18 123.41 71.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.424 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.5 p30 -101.03 -179.69 4.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.384 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.837 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 4.3 t80 -53.65 -50.31 66.05 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 123.558 0.537 . . . . 0.0 111.209 -174.424 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.63 -20.43 64.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.68 -176.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.607 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -80.12 -52.92 7.19 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 -176.506 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.837 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -70.14 -33.31 71.63 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.274 178.182 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.37 -41.23 93.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.845 0.355 . . . . 0.0 110.732 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.447 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 31.7 mtmm -70.69 -28.44 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.931 176.297 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 14.9 t -80.87 -17.33 51.03 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -175.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.767 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 85.8 mt . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.419 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.681 ' HB2' HD21 ' A' ' 72' ' ' LEU . 94.0 mmm . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.17 158.38 39.33 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-O 119.635 -0.221 . . . . 0.0 110.48 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.601 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 9.6 Cg_endo -52.34 -43.34 54.64 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.904 2.403 . . . . 0.0 113.618 -173.708 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -54.03 51.38 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.933 -175.129 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.8 pm0 -72.36 -28.76 63.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.679 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.786 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 25.7 mt -63.87 -19.7 65.27 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.965 0.412 . . . . 0.0 110.938 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.782 ' HG2' HD21 ' A' ' 145' ' ' LEU . 17.8 mt-30 -66.15 -39.32 89.72 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 174.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.529 ' HG ' ' HG2' ' A' ' 78' ' ' LYS . 30.8 tp -77.22 -19.17 57.03 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.835 173.291 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.786 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 5.5 t-80 -73.32 -38.67 65.74 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.486 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.68 ' CD2' HG22 ' A' ' 100' ' ' VAL . 6.9 m-30 -68.14 -41.61 81.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.035 175.022 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.664 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 50.0 t80 -66.37 -52.64 44.7 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.522 -175.551 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.664 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.6 mmmt -77.71 -15.77 58.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.989 -175.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.415 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 35.4 tpp -45.39 -44.87 12.28 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 123.84 0.712 . . . . 0.0 111.883 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.542 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -132.48 7.68 4.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.404 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.512 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 24.0 t70 -92.75 85.35 5.19 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.832 0.825 . . . . 0.0 109.487 178.03 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.542 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 23.0 m-85 -96.64 -8.89 30.48 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.209 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -88.63 -16.37 32.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.732 -175.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.72 28.17 65.13 Favored Glycine 0 CA--C 1.524 0.637 0 CA-C-N 115.886 -0.597 . . . . 0.0 113.764 176.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . 0.45 ' O ' ' HB3' ' A' ' 86' ' ' ASN . 18.9 p-10 -95.44 18.1 13.31 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 117.412 0.606 . . . . 0.0 111.5 -174.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 85' ' ' ASN . 4.3 t-20 76.48 -27.09 0.18 Allowed 'General case' 0 N--CA 1.47 0.557 0 O-C-N 123.782 0.676 . . . . 0.0 112.046 175.031 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.6 mm? -112.81 162.63 15.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.105 0.955 . . . . 0.0 112.459 -176.377 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.507 HD21 ' HB2' ' A' ' 81' ' ' ASP . 1.3 mt -132.26 123.38 26.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.612 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.433 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.0 p-10 -96.25 175.44 6.44 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.41 -37.32 12.14 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 114.108 0.403 . . . . 0.0 114.108 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.433 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 54.6 mt -65.13 -52.52 54.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.468 0.634 . . . . 0.0 110.707 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.512 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 43.9 mt-10 -61.47 -54.67 40.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.307 1.051 . . . . 0.0 109.33 174.147 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.995 ' HG ' HG12 ' A' ' 97' ' ' ILE . 5.5 tp -66.45 -9.82 37.99 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.836 -1.529 . . . . 0.0 112.917 -166.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' SER . . . . . 1.065 ' HA ' HD13 ' A' ' 121' ' ' ILE . 58.8 p -56.13 -45.32 79.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 111.343 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -23.53 51.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.218 0.532 . . . . 0.0 111.188 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.588 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -86.42 -58.38 2.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.37 -175.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.995 HG12 ' HG ' ' A' ' 93' ' ' LEU . 24.4 mm -61.85 -20.36 23.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.281 -172.031 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.788 HG23 HD21 ' A' ' 117' ' ' LEU . 99.3 m -53.33 -31.52 44.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.081 0.467 . . . . 0.0 110.832 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 57.3 m-70 -94.82 -37.16 11.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.112 0.482 . . . . 0.0 110.823 176.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.939 HG21 ' HE1' ' A' ' 141' ' ' PHE . 2.1 t -72.57 -50.93 31.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.033 -170.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' HIS . . . . . 0.582 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.7 t60 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.57 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.506 -0.737 0 CA-C-O 120.479 0.181 . . . . 0.0 111.012 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' PRO . . . . . 0.57 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.1 Cg_endo -77.78 67.37 7.97 Favored 'Trans proline' 0 N--CA 1.445 -1.373 0 C-N-CA 121.422 1.415 . . . . 0.0 111.492 174.242 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.55 80.69 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.886 0.85 . . . . 0.0 111.33 173.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.437 ' H ' ' HG2' ' A' ' 112' ' ' MET . 12.2 ptt? -86.59 -56.81 3.25 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.244 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.0 m -163.7 126.36 2.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.423 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -51.15 -38.91 54.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.554 -174.052 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.3 -50.44 65.68 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.048 0.451 . . . . 0.0 111.068 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -64.61 -35.05 79.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.524 0.678 . . . . 0.0 109.946 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.788 HD21 HG23 ' A' ' 98' ' ' THR . 15.7 tp -65.09 -41.62 94.82 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.368 178.086 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 114' ' ' GLU . 55.0 mt -61.56 -42.1 92.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.581 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ASN . . . . . 0.429 ' O ' ' HB3' ' A' ' 122' ' ' ASP . 91.8 m-20 -71.62 -23.92 61.79 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.218 0.533 . . . . 0.0 110.71 176.654 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.582 HG13 ' CD2' ' A' ' 101' ' ' HIS . 0.9 OUTLIER -68.31 -33.66 61.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.303 0.573 . . . . 0.0 109.935 174.065 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 1.065 HD13 ' HA ' ' A' ' 94' ' ' SER . 58.8 mt -75.16 -17.69 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 121.636 0.731 . . . . 0.0 109.861 174.294 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 19.9 t70 -75.44 -36.76 60.69 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.434 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.37 -37.27 80.65 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.671 -1.15 . . . . 0.0 113.148 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.669 HG12 ' O ' ' A' ' 121' ' ' ILE . 7.2 p -60.46 -43.34 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 CA-C-N 117.555 0.677 . . . . 0.0 109.97 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.24 -13.82 62.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.082 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.68 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 28.6 mtm-85 -99.22 -50.1 4.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.563 -178.338 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -119.07 -20.98 7.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -168.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.569 ' HB2' HG23 ' A' ' 124' ' ' VAL . 41.5 m-20 -89.89 -27.89 19.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.423 178.491 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.503 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -77.68 94.41 4.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.639 0.733 . . . . 0.0 109.316 172.484 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -80.42 -32.38 37.4 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.217 -0.902 . . . . 0.0 111.462 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.1 -0.18 56.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.676 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.503 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 73.5 m-20 63.88 28.08 14.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.7 176.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.8 p30 -84.06 -13.58 52.73 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.993 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 86.26 1.36 86.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.561 176.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.574 ' HB2' HD12 ' A' ' 87' ' ' LEU . 33.4 m-85 -130.54 176.41 8.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.458 HD12 ' CG2' ' A' ' 124' ' ' VAL . 6.3 tt -111.01 123.57 67.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.269 174.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.97 167.79 11.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.963 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.403 ' HE1' ' HA ' ' A' ' 74' ' ' LEU . 11.2 t80 -51.9 -41.2 61.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.605 0.184 . . . . 0.0 111.397 -178.108 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.78 -44.58 92.96 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.733 0.301 . . . . 0.0 110.693 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.464 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 46.5 mt-10 -67.13 -41.47 86.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.939 ' HE1' HG21 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -59.99 -54.77 42.12 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.496 178.013 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ALA . . . . . 0.541 ' O ' ' HG ' ' A' ' 145' ' ' LEU . . . -57.34 -47.04 82.61 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.875 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -65.38 -34.52 78.5 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.854 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.8 t -75.36 -29.75 59.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.939 0.4 . . . . 0.0 110.65 -177.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.782 HD21 ' HG2' ' A' ' 73' ' ' GLN . 3.9 pp . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.339 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.605 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 97.3 mmm . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 120.949 0.404 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.5 m -81.59 155.1 71.32 Favored Pre-proline 0 C--O 1.223 -0.329 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.656 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.454 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.4 Cg_exo -53.97 -51.39 10.81 Favored 'Trans proline' 0 N--CA 1.477 0.52 0 C-N-CA 122.659 2.239 . . . . 0.0 114.609 -173.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -67.2 -35.85 80.48 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.34 0.59 . . . . 0.0 110.358 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.486 ' HG2' ' CE ' ' A' ' 67' ' ' MET . 5.5 tp10 -58.04 -53.3 59.85 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.928 173.186 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.662 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 24.3 mt -58.07 -23.26 53.93 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 113.808 -1.542 . . . . 0.0 112.933 -175.679 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 13.7 mt-30 -70.93 -41.74 70.79 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 175.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.56 -25.53 66.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.141 171.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.662 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 11.3 t60 -64.38 -40.68 96.29 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.08 174.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' OH ' ' HB3' ' A' ' 99' ' ' HIS . 3.6 m-30 -67.93 -30.72 70.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.235 0.54 . . . . 0.0 109.995 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.688 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.4 t80 -69.43 -51.83 32.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.762 177.206 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.688 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.4 mmmt -79.36 -12.51 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.412 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.4 tpt -44.88 -36.83 3.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.989 0.915 . . . . 0.0 112.688 -172.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.518 ' HA ' ' CE2' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -147.57 10.23 0.95 Allowed 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.867 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.732 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 28.6 t70 -86.38 88.22 7.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.319 0.58 . . . . 0.0 110.396 -178.324 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.518 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 29.0 m-85 -112.02 -0.92 15.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.944 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -85.12 -13.82 49.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.043 -171.508 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.69 13.95 81.71 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.167 -0.54 . . . . 0.0 113.363 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -92.97 -5.29 51.02 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.712 0.756 . . . . 0.0 110.781 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 62.47 20.01 11.6 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.596 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.51 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.3 mm? -132.32 153.18 50.98 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.212 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.719 ' HB2' HG22 ' A' ' 136' ' ' ILE . 3.9 mm? -106.59 114.53 28.69 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.173 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.498 ' OD2' ' HG3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -93.77 -178.91 4.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.3 178.819 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.09 -51.04 48.91 Favored Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 114.309 0.484 . . . . 0.0 114.309 -176.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.609 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.4 pp -73.8 -28.45 61.65 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.115 0.457 . . . . 0.0 110.875 -174.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.732 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 50.4 mt-10 -66.68 -52.15 48.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.037 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 0.861 ' HB3' HG12 ' A' ' 97' ' ' ILE . 30.3 mt -66.71 -7.38 20.53 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.393 -177.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.729 ' HA ' HD13 ' A' ' 121' ' ' ILE . 75.4 m -56.84 -31.77 65.09 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.109 176.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -91.61 -32.17 15.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.074 0.464 . . . . 0.0 111.15 175.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -84.29 -41.7 16.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.226 -169.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.885 ' HB ' HG12 ' A' ' 121' ' ' ILE . 40.2 mm -68.05 -17.85 22.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -177.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.835 HG23 HD13 ' A' ' 117' ' ' LEU . 4.7 m -60.01 -25.91 65.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.166 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.5 ' HB3' ' OH ' ' A' ' 76' ' ' TYR . 62.2 m-70 -103.5 -33.56 9.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.663 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.829 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 32.6 t -58.59 -51.41 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 177.743 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.6 t60 . . . . . 0 C--O 1.233 0.2 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 167.494 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.572 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.507 -0.689 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 98' ' ' THR . 53.4 Cg_endo -79.65 65.67 8.86 Favored 'Trans proline' 0 N--CA 1.441 -1.56 0 C-N-CA 121.552 1.501 . . . . 0.0 111.323 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -49.84 94.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.505 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -106.94 -47.78 3.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.064 -179.244 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.4 m 179.99 117.96 0.05 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -177.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.538 ' O ' HG13 ' A' ' 118' ' ' ILE . 16.3 pt-20 -56.76 -36.69 70.1 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.794 -175.112 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -66.78 -45.63 77.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.833 0.349 . . . . 0.0 110.182 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.09 -44.32 96.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.644 0.735 . . . . 0.0 109.888 177.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.835 HD13 HG23 ' A' ' 98' ' ' THR . 11.7 mt -60.23 -37.7 81.13 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.699 -1.137 . . . . 0.0 111.521 176.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.705 ' HA ' HD12 ' A' ' 121' ' ' ILE . 61.8 mt -61.07 -37.34 77.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.839 0.352 . . . . 0.0 110.91 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -65.38 -38.14 89.14 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.477 0.656 . . . . 0.0 109.266 174.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.417 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -61.57 -42.16 92.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.765 174.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.885 HG12 ' HB ' ' A' ' 97' ' ' ILE . 93.3 mt -60.52 -36.93 73.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.603 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.829 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 33.9 t70 -61.31 -43.64 98.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.241 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.59 -29.04 60.52 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.718 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.799 HG21 HD12 ' A' ' 97' ' ' ILE . 79.1 t -65.01 -53.81 36.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.494 0.187 . . . . 0.0 110.759 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 67.4 mt -65.65 -14.11 60.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.37 -175.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.829 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 15.9 mtp85 -103.66 -36.0 8.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.105 -177.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -124.08 -47.08 1.92 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -170.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.583 ' HB3' HG13 ' A' ' 124' ' ' VAL . 12.6 t70 -71.91 -19.29 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.77 0.795 . . . . 0.0 109.809 -178.341 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.536 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 1.6 t70 -72.56 90.85 1.37 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.689 166.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -79.19 -27.9 42.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.214 -170.129 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -88.26 -3.66 58.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.76 -176.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.536 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 14.1 t30 61.65 49.48 4.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.586 0.708 . . . . 0.0 110.727 179.388 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 52.8 p30 -107.62 -8.29 16.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.516 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.37 1.31 90.41 Favored Glycine 0 C--N 1.329 0.183 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.055 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.51 ' HB2' HD12 ' A' ' 87' ' ' LEU . 50.4 m-85 -131.21 178.02 7.02 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 174.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.719 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.1 tt -114.97 126.21 72.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.217 0.532 . . . . 0.0 109.607 175.244 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -102.78 -178.22 3.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.704 175.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.835 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 44.1 t80 -56.75 -46.91 81.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 123.341 0.4 . . . . 0.0 111.598 -172.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.2 -28.27 67.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.646 0.26 . . . . 0.0 111.344 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.496 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.5 mt-10 -72.74 -56.37 5.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.231 -175.11 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.835 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.9 p90 -70.6 -27.72 64.3 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.159 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.52 -34.24 77.76 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.337 179.198 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.418 ' HB2' ' HE3' ' A' ' 143' ' ' LYS . 47.4 mtmt -76.7 -32.61 57.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.374 177.244 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' SER . . . . . 0.551 ' OG ' ' HA ' ' A' ' 141' ' ' PHE . 1.3 p -82.27 -30.36 30.68 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.572 -174.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.5 pp . . . . . 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.512 178.56 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.565 ' HB2' HD21 ' A' ' 72' ' ' LEU . 92.3 mmm . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.49 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 6.3 m -76.4 160.7 77.0 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -178.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.49 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 9.9 Cg_endo -52.79 -43.69 53.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.928 2.418 . . . . 0.0 112.693 -178.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 6.9 pt20 -56.98 -48.37 78.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.531 178.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.414 ' H ' ' HG3' ' A' ' 70' ' ' GLN . 3.8 mm-40 -59.61 -52.97 63.26 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.502 175.207 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.588 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 24.3 mt -60.38 -21.68 62.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.184 -166.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLN . . . . . 0.565 ' HG2' HD21 ' A' ' 145' ' ' LEU . 76.8 mt-30 -70.34 -46.2 64.62 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 174.222 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.9 tp -66.15 -22.36 66.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.831 172.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.588 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.1 t60 -66.98 -42.97 84.19 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.141 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.717 ' CD2' HG22 ' A' ' 100' ' ' VAL . 4.3 m-30 -70.32 -31.47 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 178.03 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.612 ' HD1' ' HE1' ' A' ' 141' ' ' PHE . 57.6 t80 -67.59 -53.28 29.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -80.62 -13.85 58.69 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.581 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.462 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.6 tpt -44.23 -40.0 4.84 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.752 0.821 . . . . 0.0 112.401 -170.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.671 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -146.49 10.41 1.09 Allowed 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.944 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.625 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.4 t70 -84.63 85.15 7.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.408 0.623 . . . . 0.0 109.764 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' TYR . . . . . 0.671 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 69.5 m-85 -104.14 -6.66 20.84 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.511 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 p30 -77.76 -13.86 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.203 0.525 . . . . 0.0 110.943 -178.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 67.34 26.86 73.47 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.554 -0.748 . . . . 0.0 113.161 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -99.98 -2.87 33.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 117.464 0.632 . . . . 0.0 110.462 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 63.12 31.89 15.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.349 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.547 HD22 ' HB2' ' A' ' 135' ' ' TYR . 15.8 mt -141.89 141.09 33.02 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.529 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.728 ' HB2' HG22 ' A' ' 136' ' ' ILE . 4.0 mm? -95.36 109.25 21.44 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -83.95 161.88 20.64 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.784 175.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.96 -48.5 24.85 Favored Glycine 0 C--O 1.23 -0.15 0 CA-C-O 119.782 -0.455 . . . . 0.0 113.842 -178.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.723 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.1 pp -68.48 -32.27 72.15 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 117.409 0.604 . . . . 0.0 111.592 -175.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.723 ' N ' HD12 ' A' ' 91' ' ' LEU . 50.4 mt-10 -71.25 -58.78 3.22 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.555 1.169 . . . . 0.0 108.272 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LEU . . . . . 1.118 ' HG ' HG12 ' A' ' 97' ' ' ILE . 12.3 tp -60.84 -11.5 7.96 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 112.897 -1.956 . . . . 0.0 111.466 -174.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.846 ' HA ' HD13 ' A' ' 121' ' ' ILE . 7.9 m -52.72 -32.28 42.13 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.448 0.699 . . . . 0.0 112.71 178.544 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.0 -35.2 15.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.958 178.006 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.714 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -75.36 -41.3 56.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.276 -170.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 1.118 HG12 ' HG ' ' A' ' 93' ' ' LEU . 26.8 mm -60.07 -19.89 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -174.77 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.692 HG23 HD21 ' A' ' 117' ' ' LEU . 4.4 m -55.25 -27.94 49.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.35 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 58.6 m-70 -107.93 -18.08 13.89 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.929 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.717 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.3 t -84.99 -53.52 10.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.531 -174.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 21.2 t60 . . . . . 0 C--O 1.235 0.323 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 178.778 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.561 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.511 -0.521 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -80.81 69.64 7.87 Favored 'Trans proline' 0 N--CA 1.441 -1.589 0 C-N-CA 121.795 1.663 . . . . 0.0 111.197 174.235 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.9 75.34 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.015 0.912 . . . . 0.0 110.734 171.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.402 ' HG2' ' H ' ' A' ' 112' ' ' MET . 12.8 ptt? -95.26 -58.01 2.25 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.04 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 13.7 m -160.99 127.24 3.93 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 176.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.594 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.72 -38.38 64.26 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.805 -178.011 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.504 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 20.7 t70 -64.8 -46.22 82.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.27 0.557 . . . . 0.0 110.861 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.57 -38.66 91.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.291 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.692 HD21 HG23 ' A' ' 98' ' ' THR . 6.7 tp -63.85 -32.12 73.53 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.309 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.594 HG13 ' O ' ' A' ' 114' ' ' GLU . 73.9 mt -59.36 -45.48 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.129 174.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -64.29 -38.17 90.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.3 0.572 . . . . 0.0 110.039 175.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ILE . . . . . 0.547 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.3 mp -58.51 -46.67 89.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.068 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.846 HD13 ' HA ' ' A' ' 94' ' ' SER . 71.4 mt -62.9 -45.49 98.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 0.0 110.39 177.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ASP . . . . . 0.517 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.6 t70 -57.77 -44.94 86.51 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.12 52.52 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.691 177.516 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' VAL . . . . . 0.944 HG21 HD12 ' A' ' 97' ' ' ILE . 46.2 t -65.3 -54.77 25.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.805 174.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.92 -7.25 26.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.193 0.52 . . . . 0.0 111.441 -176.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 9.9 mtt180 -107.74 -36.04 6.52 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.834 -178.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -127.12 -41.79 1.75 Allowed 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.54 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 1.3 m-20 -71.73 -18.47 62.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.497 0.665 . . . . 0.0 110.22 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASP . . . . . 0.596 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 2.2 t70 -77.81 93.12 4.29 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 165.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -79.09 -21.46 46.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.039 -169.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.63 -4.54 53.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -176.248 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ASN . . . . . 0.421 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 20.3 m120 61.25 34.78 18.52 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.379 -177.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -93.42 -15.16 25.93 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.767 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.3 -2.89 75.34 Favored Glycine 0 N--CA 1.453 -0.17 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.965 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' TYR . . . . . 0.547 ' HB2' HD22 ' A' ' 87' ' ' LEU . 45.5 m-85 -129.35 164.86 22.67 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 120.971 0.415 . . . . 0.0 110.005 178.308 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ILE . . . . . 0.728 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.4 tt -106.34 126.59 62.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.509 175.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.575 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 0.2 OUTLIER -103.23 178.96 4.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.304 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 138' ' ' TYR . . . . . 0.811 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.9 t80 -53.02 -48.02 67.88 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.363 0.414 . . . . 0.0 111.264 -176.21 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.65 -30.02 69.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.963 0.411 . . . . 0.0 111.491 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' GLU . . . . . 0.596 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.1 mt-10 -73.92 -50.79 18.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.251 -177.149 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' PHE . . . . . 0.811 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -74.7 -25.49 59.18 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.596 178.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.97 -43.03 91.31 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.129 0.49 . . . . 0.0 110.102 175.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' LYS . . . . . 0.421 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 34.5 mtmm -74.72 -28.44 60.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.745 176.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.2 t -78.55 -43.04 27.64 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.065 -171.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.565 HD21 ' HG2' ' A' ' 73' ' ' GLN . 2.8 pp . . . . . 0 N--CA 1.462 0.173 0 CA-C-O 120.943 0.401 . . . . 0.0 111.387 -175.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.622 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.3 mmm . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.655 0.264 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.647 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 41.0 t -88.01 147.82 41.7 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.175 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.66 -44.11 37.1 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.002 2.468 . . . . 0.0 114.125 -174.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.548 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 7.3 pt20 -56.81 -52.91 63.21 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.676 -177.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.647 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.1 pt-20 -73.1 -26.45 61.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.493 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.622 HD21 ' HB2' ' A' ' 67' ' ' MET . 18.0 mt -65.57 -17.68 64.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.717 0.294 . . . . 0.0 111.294 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -69.93 -47.28 63.01 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 172.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.2 tp -66.3 -19.64 65.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.582 174.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.545 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 11.1 t-80 -68.19 -41.84 80.82 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.718 175.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.692 ' CD2' HG22 ' A' ' 100' ' ' VAL . 4.8 m-30 -66.49 -28.53 68.65 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.482 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.934 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 64.8 t80 -73.29 -53.87 9.77 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.649 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.481 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -79.62 -12.99 59.81 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.206 -175.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.403 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.1 tpt -44.52 -41.3 6.31 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.839 0.712 . . . . 0.0 111.901 -174.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.506 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -140.81 9.91 2.19 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.863 179.573 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.524 ' HB2' HD21 ' A' ' 88' ' ' LEU . 27.3 t70 -86.26 88.81 7.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 110.268 178.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.506 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 21.7 m-85 -106.14 14.53 27.56 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.37 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -112.94 -15.41 12.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.319 -176.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 60.23 27.24 64.97 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.743 -0.662 . . . . 0.0 114.426 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -89.3 3.33 52.48 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 117.766 0.783 . . . . 0.0 110.765 -178.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.934 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 2.6 t30 68.84 20.3 8.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.425 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.534 HD22 ' HB2' ' A' ' 135' ' ' TYR . 40.8 mt -143.27 158.47 43.6 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.574 0.702 . . . . 0.0 111.248 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.589 HD11 ' HA ' ' A' ' 77' ' ' PHE . 70.6 mt -125.78 118.12 24.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.391 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.57 169.66 12.57 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.94 -35.69 54.16 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.403 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.5 mt -59.07 -42.8 91.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.262 0.553 . . . . 0.0 110.594 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.421 ' HA ' ' ND1' ' A' ' 80' ' ' HIS . 37.3 mt-10 -70.76 -50.59 34.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.035 0.921 . . . . 0.0 109.203 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 97' ' ' ILE . 29.4 mt -65.77 -12.22 52.17 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.733 -171.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.717 ' HA ' HD13 ' A' ' 121' ' ' ILE . 24.4 p -55.61 -31.95 62.7 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.545 0.212 . . . . 0.0 111.4 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.83 -36.82 14.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.234 0.54 . . . . 0.0 111.145 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.57 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.2 -43.91 20.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.744 -168.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.894 HD12 HG21 ' A' ' 124' ' ' VAL . 32.6 mm -62.82 -20.52 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.673 -174.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.713 HG23 HD21 ' A' ' 117' ' ' LEU . 17.5 m -56.39 -21.3 24.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.488 174.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -108.67 -44.5 4.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.207 174.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.692 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.9 t -59.16 -48.79 85.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.67 -173.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.47 ' CD2' HG13 ' A' ' 120' ' ' ILE . 27.8 t60 -80.59 76.53 7.44 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.765 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.559 ' HB2' ' O ' ' A' ' 105' ' ' GLY . 21.1 pttm -58.28 112.42 1.55 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.168 177.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -107.24 -74.52 0.66 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -106.88 46.71 0.91 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.139 0.495 . . . . 0.0 109.869 176.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 102' ' ' LYS . . . 179.61 178.27 48.32 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.054 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 17.0 m -106.42 -80.16 0.56 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.893 0.346 . . . . 0.0 110.704 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -96.66 -19.06 19.28 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 121.082 0.467 . . . . 0.0 110.851 176.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -73.31 135.2 44.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.733 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -70.23 114.35 25.03 Favored Pre-proline 0 CA--C 1.507 -0.695 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.096 177.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 3.4 Cg_exo -79.41 67.73 8.51 Favored 'Trans proline' 0 N--CA 1.439 -1.702 0 C-N-CA 121.496 1.464 . . . . 0.0 111.379 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.71 83.47 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.945 0.879 . . . . 0.0 110.779 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.456 ' H ' ' HG2' ' A' ' 112' ' ' MET . 12.8 ptt? -102.95 -54.24 2.67 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.837 -176.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.7 m -161.38 119.15 2.31 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.62 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.04 -40.67 67.29 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.466 ' HA ' HD12 ' A' ' 118' ' ' ILE . 33.9 m-20 -71.9 -40.67 68.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.793 0.33 . . . . 0.0 110.926 -178.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -63.89 -37.02 85.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.469 0.652 . . . . 0.0 109.357 173.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.713 HD21 HG23 ' A' ' 98' ' ' THR . 12.5 tp -65.93 -31.97 73.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.066 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 114' ' ' GLU . 88.1 mt -61.18 -45.19 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.895 0.379 . . . . 0.0 110.249 174.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -66.76 -31.79 72.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.844 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.571 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -62.31 -42.57 95.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.202 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.887 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.3 mt -64.59 -48.27 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.903 176.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 70.6 m-20 -50.81 -48.17 59.78 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.25 -28.42 34.66 Favored Glycine 0 C--O 1.224 -0.471 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.491 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.894 HG21 HD12 ' A' ' 97' ' ' ILE . 54.9 t -72.08 -55.04 14.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 O-C-N 122.708 -0.289 . . . . 0.0 111.125 174.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.8 mp -65.92 -13.98 60.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.313 0.578 . . . . 0.0 111.044 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 47.7 mtt180 -110.48 -29.59 8.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.881 -175.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -125.91 -46.44 1.69 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.549 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 19.3 m-20 -68.06 -22.52 64.93 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 121.243 0.544 . . . . 0.0 110.275 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.486 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 0.8 OUTLIER -76.09 99.53 4.67 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.818 168.626 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -80.75 -17.43 51.0 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.657 -171.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.88 -0.08 43.11 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.531 -173.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.6 m120 61.75 37.53 15.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.996 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -99.6 -19.62 16.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.52 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 85.87 6.54 82.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.436 178.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.534 ' HB2' HD22 ' A' ' 87' ' ' LEU . 50.9 m-85 -126.78 160.74 29.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.665 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.501 HG22 ' HB2' ' A' ' 88' ' ' LEU . 7.3 tt -110.86 117.39 54.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.082 0.944 . . . . 0.0 110.568 178.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -90.33 168.64 11.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.258 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.797 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 7.3 t80 -51.83 -47.24 64.43 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.37 -26.49 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.04 0.447 . . . . 0.0 110.984 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.486 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 44.2 mt-10 -76.12 -53.31 8.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.97 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.797 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -72.49 -26.39 61.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.587 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.71 -42.42 97.19 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 174.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.428 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.5 mtmm -71.57 -28.92 64.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.781 176.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.1 t -80.21 -39.09 29.83 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.727 -172.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.3 pp -84.9 -15.12 45.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.991 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.083 173.858 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.63 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.1 mmm . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 120.653 0.263 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -91.74 156.58 42.67 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.858 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.42 -50.75 12.82 Favored 'Trans proline' 0 N--CA 1.475 0.436 0 C-N-CA 122.85 2.367 . . . . 0.0 114.146 -173.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -62.45 -42.76 99.7 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.765 -174.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 17.5 pt-20 -77.6 -27.33 51.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.059 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.63 HD21 ' HB2' ' A' ' 67' ' ' MET . 13.5 mt -68.23 -17.96 64.44 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 120.745 0.307 . . . . 0.0 111.479 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.491 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 16.2 mt-30 -70.76 -45.74 64.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 171.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.76 -20.62 66.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.641 173.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.525 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 62.3 t60 -68.7 -33.24 73.61 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.385 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.429 ' HD1' HG22 ' A' ' 100' ' ' VAL . 4.3 m-30 -72.12 -31.51 66.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 175.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.659 ' HB2' ' HZ ' ' A' ' 141' ' ' PHE . 47.6 t80 -69.03 -53.2 21.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.284 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.57 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.56 -10.4 59.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.678 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.497 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 4.8 tpt -44.08 -39.43 4.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.904 0.881 . . . . 0.0 112.749 -171.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.518 ' O ' ' HG3' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -144.74 10.21 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.344 -178.92 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.795 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.5 t70 -74.83 94.84 2.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.617 0.722 . . . . 0.0 110.819 -176.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -122.02 18.83 10.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.652 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -108.08 -13.67 14.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -178.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 70.74 15.25 73.45 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.509 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -95.13 -4.85 45.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.657 0.728 . . . . 0.0 111.012 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.409 ' O ' HD22 ' A' ' 87' ' ' LEU . 47.2 m-80 62.69 19.76 11.6 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.691 177.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.537 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.4 mm? -129.14 163.31 25.79 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.656 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 86.9 mt -120.09 113.74 20.93 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 121.212 -0.195 . . . . 0.0 110.685 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.508 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 0.0 OUTLIER -86.25 175.66 8.35 Favored 'General case' 0 C--O 1.209 -1.059 0 O-C-N 123.794 0.684 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.44 -53.72 23.41 Favored Glycine 0 CA--C 1.518 0.232 0 N-CA-C 114.548 0.579 . . . . 0.0 114.548 -176.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.618 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.9 pp -80.33 -28.63 38.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.574 0.687 . . . . 0.0 111.573 -172.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.795 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 40.7 tt0 -70.54 -51.45 28.61 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.891 0.853 . . . . 0.0 108.866 173.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 1.025 ' HG ' HG12 ' A' ' 97' ' ' ILE . 17.1 tp -65.95 -12.57 55.81 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.018 -179.165 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.805 ' HA ' HD13 ' A' ' 121' ' ' ILE . 28.0 m -52.96 -31.89 42.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.187 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 m -87.71 -22.26 24.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.07 0.462 . . . . 0.0 111.287 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.795 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -93.08 -39.18 11.22 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -171.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 1.025 HG12 ' HG ' ' A' ' 93' ' ' LEU . 43.6 mm -64.83 -21.55 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-O 120.962 0.41 . . . . 0.0 110.777 -179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.866 HG23 HD21 ' A' ' 117' ' ' LEU . 3.4 m -57.9 -24.77 59.21 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -111.78 -27.55 8.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.986 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.769 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 40.5 t -61.7 -59.81 3.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 175.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 49.4 t60 -79.01 80.35 5.35 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.312 0.577 . . . . 0.0 110.11 174.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.541 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -79.94 123.16 27.55 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.344 175.284 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -85.49 -56.11 3.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.848 -175.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -123.02 46.55 2.15 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.12 0.486 . . . . 0.0 111.402 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.88 -161.19 26.8 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.464 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 28.6 m -117.98 -47.32 2.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.376 0.608 . . . . 0.0 109.802 175.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.568 ' CD ' ' H ' ' A' ' 107' ' ' GLU . 0.0 OUTLIER -93.05 -39.39 11.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.144 -179.183 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -56.63 116.32 3.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.52 -1.218 . . . . 0.0 113.043 -171.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.865 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -71.19 116.11 43.53 Favored Pre-proline 0 CA--C 1.504 -0.812 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.968 172.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.461 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.2 Cg_endo -79.84 67.1 8.72 Favored 'Trans proline' 0 N--CA 1.438 -1.748 0 C-N-CA 121.343 1.362 . . . . 0.0 111.625 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.21 78.97 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 122.144 0.973 . . . . 0.0 110.37 172.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.472 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.4 ptt? -97.76 -56.39 2.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.063 -1.426 . . . . 0.0 110.671 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.0 m -155.62 119.31 4.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.439 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.8 pt-20 -56.9 -37.5 71.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.868 -170.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.53 -45.23 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.451 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.53 -39.43 94.4 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.265 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.866 HD21 HG23 ' A' ' 98' ' ' THR . 13.2 tp -62.23 -38.36 88.93 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.288 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 114' ' ' GLU . 76.5 mt -63.46 -41.88 94.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 174.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -67.26 -30.6 70.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.307 0.575 . . . . 0.0 110.16 175.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.425 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -63.36 -43.0 98.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.1 173.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.805 HD13 ' HA ' ' A' ' 94' ' ' SER . 82.0 mt -63.79 -47.35 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.646 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.722 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 0.5 OUTLIER -52.52 -47.74 66.47 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.363 176.216 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.19 -34.38 53.22 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.18 -0.533 . . . . 0.0 111.903 177.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 52.5 t -65.78 -52.07 54.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.621 0.248 . . . . 0.0 110.661 175.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.425 HD11 HD23 ' A' ' 93' ' ' LEU . 8.9 mp -67.74 -1.05 4.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.67 -177.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.722 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.9 mtm180 -118.2 -32.62 4.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.605 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -123.77 -45.51 2.03 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -176.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.526 ' HB2' HG13 ' A' ' 124' ' ' VAL . 4.4 m-20 -71.97 -17.05 62.09 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.132 0.492 . . . . 0.0 110.4 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.577 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.8 t70 -76.36 93.25 3.44 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 166.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -79.37 -17.59 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.604 -168.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.45 8.07 16.42 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.244 -170.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.421 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 86.8 m-20 61.02 36.2 18.62 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.984 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.7 p30 -98.38 -4.12 35.47 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.784 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.2 -16.27 23.86 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.986 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.537 ' HB2' HD12 ' A' ' 87' ' ' LEU . 16.5 m-85 -116.21 173.94 6.32 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.543 HD13 ' HB3' ' A' ' 141' ' ' PHE . 7.1 tt -108.7 121.98 62.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.705 177.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -91.58 170.11 10.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.345 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.769 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 38.1 t80 -52.33 -48.77 65.28 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.113 0.258 . . . . 0.0 110.63 -178.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.6 -28.01 69.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.928 0.394 . . . . 0.0 111.686 -176.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.577 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 47.7 mt-10 -76.98 -49.21 15.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.481 -173.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.769 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -76.29 -27.99 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.534 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.99 88.01 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.853 0.359 . . . . 0.0 110.553 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.412 ' HE3' ' HB2' ' A' ' 143' ' ' LYS . 47.6 mtmt -77.42 -29.01 52.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.527 175.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 21.7 t -75.58 -34.55 60.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.481 -175.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 pp -80.98 9.3 6.72 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.464 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 . . . . . 0 C--O 1.246 0.89 0 CA-C-O 118.544 -0.741 . . . . 0.0 110.071 175.847 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.647 ' HB2' HD21 ' A' ' 72' ' ' LEU . 96.9 mmm . . . . . 0 N--CA 1.463 0.194 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.449 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 55.3 m -116.8 162.99 24.38 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.451 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 81.1 Cg_exo -50.35 -49.33 16.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.284 2.656 . . . . 0.0 115.222 -172.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.403 ' HG3' ' OE1' ' A' ' 71' ' ' GLU . 19.7 pt20 -59.31 -48.68 80.73 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -172.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.449 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 1.7 pm0 -72.98 -28.65 62.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.707 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 67' ' ' MET . 27.6 mt -68.09 -17.62 64.43 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.166 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.451 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 28.7 mt-30 -69.59 -47.46 63.46 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.91 -19.36 65.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.697 173.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.571 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 10.2 t-80 -71.57 -42.29 68.0 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.908 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.793 ' CD2' HG22 ' A' ' 100' ' ' VAL . 7.4 m-30 -66.95 -29.09 68.86 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.557 ' HA ' HD11 ' A' ' 88' ' ' LEU . 58.0 t80 -73.01 -50.39 23.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.864 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.453 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.3 mmmt -80.94 -26.62 36.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -175.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.3 tpp -44.72 -53.94 6.79 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -170.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.469 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -122.54 9.18 9.6 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.438 -174.532 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.673 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.0 t70 -83.89 72.8 10.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 109.554 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.423 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.8 OUTLIER -98.17 -7.02 30.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.915 -178.461 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -77.22 -13.65 59.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.8 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.3 24.06 74.19 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.414 -0.812 . . . . 0.0 113.381 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.476 ' ND2' ' HB2' ' A' ' 87' ' ' LEU . 14.1 p-10 -104.57 -9.71 18.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 117.64 0.72 . . . . 0.0 111.719 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.8 m120 67.71 30.21 6.54 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.57 HD22 ' HB2' ' A' ' 135' ' ' TYR . 13.6 mt -138.47 163.95 30.63 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.298 -0.865 . . . . 0.0 108.939 172.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.557 HD11 ' HA ' ' A' ' 77' ' ' PHE . 84.2 mt -125.86 117.51 23.52 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 123.23 0.331 . . . . 0.0 110.974 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.598 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.7 p30 -98.87 -170.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.317 177.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.12 -50.22 56.36 Favored Glycine 0 C--N 1.329 0.177 0 N-CA-C 114.32 0.488 . . . . 0.0 114.32 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.694 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.7 pp -75.0 -29.48 60.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.52 0.66 . . . . 0.0 110.749 -173.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.694 ' N ' HD12 ' A' ' 91' ' ' LEU . 47.9 mt-10 -68.8 -50.04 53.55 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 97' ' ' ILE . 40.8 mt -66.82 -13.17 61.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.959 -178.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.649 ' HA ' HD13 ' A' ' 121' ' ' ILE . 48.4 m -57.39 -32.24 66.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.646 0.26 . . . . 0.0 111.321 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 m -92.39 -33.45 14.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 110.883 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.681 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.98 -51.08 8.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.091 -169.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.867 HD12 HG21 ' A' ' 124' ' ' VAL . 24.3 mm -57.66 -24.68 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.908 -174.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.637 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 4.2 m -58.4 -22.14 52.91 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.188 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.511 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 43.8 m-70 -106.67 -19.84 13.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.826 174.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.793 HG22 ' CD2' ' A' ' 76' ' ' TYR . 12.4 t -86.01 -60.14 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -170.463 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.43 ' CD2' HG13 ' A' ' 120' ' ' ILE . 74.1 t60 -51.2 125.79 14.95 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.373 0.42 . . . . 0.0 111.766 -170.345 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 144' ' ' SER . 23.7 ttmm -69.13 77.02 0.35 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.507 -173.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -113.46 -63.61 1.42 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 165.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.776 ' HB2' ' HB3' ' A' ' 110' ' ' PRO . 36.4 mt-10 -132.08 28.76 4.43 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 167.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -102.35 122.39 7.51 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 114.74 -1.118 . . . . 0.0 113.211 -169.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 48.4 m -153.31 -67.9 0.15 Allowed 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -107.25 -52.08 2.82 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.682 167.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -71.62 155.94 39.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.562 -1.199 . . . . 0.0 112.113 -178.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.492 ' HB2' ' CE1' ' A' ' 99' ' ' HIS . . . -100.17 122.04 51.66 Favored Pre-proline 0 N--CA 1.447 -0.584 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.462 174.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.776 ' HB3' ' HB2' ' A' ' 104' ' ' GLU . 45.4 Cg_endo -71.02 63.94 2.53 Favored 'Trans proline' 0 N--CA 1.455 -0.735 0 C-N-CA 122.11 1.873 . . . . 0.0 111.769 170.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.94 79.03 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.742 0.782 . . . . 0.0 111.299 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.405 ' H ' ' HG2' ' A' ' 112' ' ' MET . 18.3 ptt? -90.55 -59.16 2.25 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.67 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 75.4 m -167.36 129.93 1.68 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.596 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.4 OUTLIER -62.18 -28.26 69.54 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 123.264 0.352 . . . . 0.0 111.861 -175.028 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.71 -42.42 70.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -64.14 -40.71 96.74 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.506 HD11 ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER -62.76 -36.26 82.49 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.919 -1.492 . . . . 0.0 110.563 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.596 HG13 ' O ' ' A' ' 114' ' ' GLU . 68.6 mt -60.37 -43.48 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.904 0.383 . . . . 0.0 110.374 175.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.61 -38.32 87.19 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.606 0.717 . . . . 0.0 109.648 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.467 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -64.22 -39.99 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.3 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.805 ' HA ' HG21 ' A' ' 97' ' ' ILE . 79.2 mt -65.71 -41.82 91.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.466 178.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.767 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.1 t70 -62.94 -43.3 99.18 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.15 -30.39 57.66 Favored Glycine 0 C--O 1.224 -0.498 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.276 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 45.6 t -65.43 -49.28 79.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.747 0.308 . . . . 0.0 110.932 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 134' ' ' GLY . 96.2 mt -67.82 -9.89 48.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.995 0.426 . . . . 0.0 111.195 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.767 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.4 mtp85 -107.93 -34.78 6.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.308 -178.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -121.62 -47.31 2.22 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -171.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.539 ' HB2' HG13 ' A' ' 124' ' ' VAL . 15.1 m-20 -71.94 -21.11 61.65 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.058 0.456 . . . . 0.0 110.788 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.537 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.2 t70 -76.66 91.44 3.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 168.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -78.43 -18.25 55.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.627 -167.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -117.25 16.02 14.87 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.789 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 56.84 44.16 23.74 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.563 170.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.08 -15.46 15.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.692 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.407 ' O ' HD22 ' A' ' 125' ' ' LEU . . . 87.82 1.97 82.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.203 176.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.57 ' HB2' HD22 ' A' ' 87' ' ' LEU . 45.9 m-85 -132.74 170.88 14.62 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.499 HG22 HD21 ' A' ' 93' ' ' LEU . 7.1 tt -111.35 122.49 65.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.331 0.586 . . . . 0.0 109.739 174.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -103.3 -177.04 3.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.099 176.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.851 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.3 t80 -55.04 -48.99 72.7 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.551 0.532 . . . . 0.0 111.694 -171.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -23.18 64.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.004 0.43 . . . . 0.0 111.464 -175.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.537 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 51.7 mt-10 -80.69 -53.11 6.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -174.015 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.851 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.8 p90 -68.88 -32.11 71.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.047 177.593 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.77 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.998 0.428 . . . . 0.0 110.671 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -72.72 -29.34 63.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.38 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.438 ' O ' ' HB2' ' A' ' 102' ' ' LYS . 9.0 t -79.84 -25.47 40.77 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -174.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.827 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 76.5 mt -79.96 -57.53 3.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.311 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 . . . . . 0 C--O 1.245 0.85 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.118 -177.751 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.652 ' HB2' HD21 ' A' ' 72' ' ' LEU . 93.5 mmm . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.828 0.347 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.545 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 5.8 m -85.53 153.83 58.84 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.874 177.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.604 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 18.9 Cg_endo -59.77 -26.96 83.8 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.463 2.775 . . . . 0.0 114.698 -169.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.436 ' HG3' ' H ' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -68.68 -54.92 13.35 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 121.421 0.629 . . . . 0.0 109.939 -177.155 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.545 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 1.7 pm0 -67.85 -27.04 66.35 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.249 174.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.751 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 15.1 mt -65.88 -20.62 66.29 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.403 177.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.768 ' HG2' HD13 ' A' ' 145' ' ' LEU . 20.8 mt-30 -72.22 -40.83 67.5 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.01 -24.38 65.11 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.751 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 18.0 t60 -68.92 -39.17 79.78 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.096 176.083 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.77 ' CD2' HG22 ' A' ' 100' ' ' VAL . 3.9 m-30 -66.94 -34.95 78.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.279 0.561 . . . . 0.0 109.813 175.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.54 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 59.1 t80 -68.48 -53.35 23.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.24 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.405 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 28.0 mmmt -80.28 -12.33 59.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.61 -175.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.49 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.4 tpt -44.62 -38.89 4.59 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.928 0.768 . . . . 0.0 112.435 -172.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.622 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 1.0 OUTLIER -146.5 11.49 1.14 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.293 -179.645 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.743 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 25.0 t70 -82.56 90.9 6.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.614 0.721 . . . . 0.0 110.326 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -105.01 -10.84 16.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.4 p30 -83.89 -13.7 52.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.606 -173.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 64.09 24.43 68.7 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.358 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -95.07 5.12 52.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.343 0.572 . . . . 0.0 111.018 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.54 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 19.6 m120 59.19 32.34 21.96 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.129 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 27.5 mt -151.31 160.14 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.63 178.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.602 ' HB2' HG22 ' A' ' 136' ' ' ILE . 60.7 mt -121.32 123.54 42.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.503 176.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.578 ' OD2' ' HG ' ' A' ' 91' ' ' LEU . 0.1 OUTLIER -92.37 177.81 6.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.583 176.71 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.27 -34.71 54.09 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.206 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.578 ' HG ' ' OD2' ' A' ' 89' ' ' ASP . 27.7 mt -71.08 -47.05 60.49 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.176 0.512 . . . . 0.0 110.099 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.743 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 50.6 mt-10 -62.45 -41.59 98.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.547 0.689 . . . . 0.0 109.586 174.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.677 ' HB3' HG12 ' A' ' 97' ' ' ILE . 34.1 mt -68.44 -15.03 63.4 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.744 -175.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.777 ' HA ' HD13 ' A' ' 121' ' ' ILE . 26.6 t -59.9 -32.48 70.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.074 0.464 . . . . 0.0 110.445 178.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 -30.26 17.78 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.393 0.616 . . . . 0.0 110.382 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.573 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -86.22 -55.49 3.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.969 -171.155 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.949 HD12 HG21 ' A' ' 124' ' ' VAL . 33.6 mm -59.03 -25.22 29.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 122.731 0.412 . . . . 0.0 111.793 -174.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.686 HG23 HD21 ' A' ' 117' ' ' LEU . 23.4 m -59.38 -16.06 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.219 0.533 . . . . 0.0 110.867 175.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 43.4 m-70 -110.77 -23.31 11.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.499 174.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.77 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.1 t -85.19 -45.9 17.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.731 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -79.77 117.85 21.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.838 -176.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 106' ' ' SER . 94.2 mttt -72.37 152.95 41.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.511 178.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -162.64 -87.18 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -91.47 -35.0 14.58 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 171.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -107.44 -177.19 22.57 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.501 ' HA ' ' HG2' ' A' ' 102' ' ' LYS . 39.2 m -136.4 -37.27 0.7 Allowed 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 117.217 0.508 . . . . 0.0 111.023 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.53 ' HG2' ' N ' ' A' ' 108' ' ' GLN . 0.4 OUTLIER -105.35 -46.41 4.22 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.092 175.223 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.53 ' N ' ' HG2' ' A' ' 107' ' ' GLU . 67.1 mt-30 -81.42 157.0 25.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.018 0.437 . . . . 0.0 111.403 -177.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.584 ' HA ' ' O ' ' A' ' 98' ' ' THR . . . -71.81 113.48 20.4 Favored Pre-proline 0 CA--C 1.506 -0.738 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.311 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -85.06 69.36 5.69 Favored 'Trans proline' 0 N--CA 1.434 -1.98 0 C-N-CA 121.738 1.626 . . . . 0.0 110.711 176.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.8 mt -61.07 78.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.958 0.885 . . . . 0.0 111.04 174.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.486 ' H ' ' HG2' ' A' ' 112' ' ' MET . 11.6 ptt? -92.74 -56.97 2.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.474 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.9 m -158.61 125.76 4.89 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.421 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.52 -37.86 68.46 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.036 -176.546 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -60.24 -49.24 78.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.435 0.636 . . . . 0.0 110.11 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.13 -41.21 90.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.922 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.686 HD21 HG23 ' A' ' 98' ' ' THR . 8.1 tp -60.79 -39.69 89.82 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.561 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 114' ' ' GLU . 43.5 mt -59.01 -44.27 90.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.636 176.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -69.77 -31.61 69.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.645 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.406 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -60.85 -46.5 96.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.125 174.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.912 ' HA ' HG21 ' A' ' 97' ' ' ILE . 83.9 mt -63.03 -47.26 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.251 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.808 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.8 t70 -60.5 -42.27 96.01 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.729 -179.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.49 -32.79 46.27 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.401 176.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.949 HG21 HD12 ' A' ' 97' ' ' ILE . 30.4 t -61.6 -51.1 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.7 0.286 . . . . 0.0 110.426 173.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.44 HD11 HD12 ' A' ' 93' ' ' LEU . 7.8 mp -66.54 -10.81 48.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.129 0.49 . . . . 0.0 110.993 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.808 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 25.8 mtp180 -99.67 -32.96 10.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.568 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -136.5 -43.28 0.61 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -171.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.653 ' HB3' HG13 ' A' ' 124' ' ' VAL . 32.0 t0 -72.95 -22.15 60.76 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.383 0.611 . . . . 0.0 110.554 -176.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.26 101.18 6.13 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 168.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -78.42 -29.96 47.39 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.25 -168.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.02 -4.12 59.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.944 -174.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 66.9 t30 59.11 36.43 24.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.741 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -96.81 -20.78 17.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.117 -176.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 106.24 -20.46 35.27 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.857 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -114.71 161.58 17.95 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.071 0.462 . . . . 0.0 110.554 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.602 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.5 tt -107.04 125.88 63.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.411 175.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -104.13 -176.86 3.2 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.822 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 10.8 t80 -54.49 -43.66 71.97 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.441 0.463 . . . . 0.0 111.494 -174.052 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.82 -37.05 81.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.577 0.227 . . . . 0.0 111.227 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.48 ' OE1' ' HA ' ' A' ' 136' ' ' ILE . 50.7 mt-10 -71.45 -53.4 14.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.986 -171.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.822 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -70.04 -23.17 63.06 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.825 -178.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.611 ' HA ' HD12 ' A' ' 145' ' ' LEU . . . -79.65 -32.89 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.204 0.526 . . . . 0.0 110.496 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -69.55 -33.01 72.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.022 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.486 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 1.4 p -81.95 -30.57 31.66 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.768 HD13 ' HG2' ' A' ' 73' ' ' GLN . 6.7 mt -53.37 -45.62 69.3 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.149 170.673 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.929 -178.244 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.629 ' HB2' HD21 ' A' ' 72' ' ' LEU . 97.2 mmm . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.473 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 20.3 m -93.54 158.23 37.14 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.912 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.541 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.4 Cg_exo -51.5 -45.68 36.18 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.129 2.552 . . . . 0.0 114.312 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -57.24 -54.73 43.52 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.023 -173.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.473 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 3.6 pm0 -71.16 -33.3 69.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.88 177.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.656 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 13.9 mt -62.72 -21.06 65.51 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.319 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.803 ' HG2' HD21 ' A' ' 145' ' ' LEU . 86.3 mt-30 -67.17 -48.03 69.21 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 173.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.2 tp -64.04 -22.34 66.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.526 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.656 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 11.9 t-80 -72.01 -43.24 65.36 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.131 178.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.562 ' CE2' HD22 ' A' ' 145' ' ' LEU . 5.3 m-30 -62.82 -32.97 74.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 176.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 32.5 t80 -70.96 -52.65 18.56 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.206 -1.361 . . . . 0.0 110.46 -178.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -79.89 -21.31 44.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.717 -175.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 19.1 tpp -44.95 -52.99 8.17 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 123.796 0.685 . . . . 0.0 112.2 -173.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.672 ' HA ' ' CE2' ' A' ' 82' ' ' TYR . 1.8 m170 -122.94 9.88 9.44 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.008 -175.706 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.566 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.0 t70 -82.69 56.01 3.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.78 0.8 . . . . 0.0 109.917 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.672 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 47.5 m-85 -71.95 -23.97 61.53 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.713 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.8 p30 -71.83 -14.88 62.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.685 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.74 28.27 65.33 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.132 -0.94 . . . . 0.0 113.491 177.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -96.07 3.81 53.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.498 0.649 . . . . 0.0 111.775 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.491 ' HA ' ' CZ ' ' A' ' 77' ' ' PHE . 12.5 m120 65.61 25.18 11.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.216 0.532 . . . . 0.0 111.492 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.487 HD22 ' HB2' ' A' ' 135' ' ' TYR . 13.4 mt -147.19 156.5 43.02 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.682 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.621 ' HB2' HG22 ' A' ' 136' ' ' ILE . 75.8 mt -123.74 121.16 34.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.9 0.381 . . . . 0.0 111.536 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.472 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 13.4 t70 -83.21 168.29 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.394 173.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.51 55.21 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.609 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.472 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.4 mt -61.55 -43.31 99.09 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.491 0.662 . . . . 0.0 110.442 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.566 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.0 mt-10 -67.43 -46.53 72.88 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.959 0.885 . . . . 0.0 109.111 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.788 ' HB3' HG12 ' A' ' 97' ' ' ILE . 24.5 mt -66.61 -9.95 40.77 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.379 -173.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.693 ' HA ' HD13 ' A' ' 121' ' ' ILE . 36.2 t -54.4 -34.73 61.88 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.642 0.258 . . . . 0.0 111.301 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m -91.19 -30.99 16.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.395 -0.522 . . . . 0.0 111.244 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.59 -46.07 14.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.828 -171.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.855 HG21 ' HA ' ' A' ' 121' ' ' ILE . 43.6 mm -65.16 -22.18 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.364 -175.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.69 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 11.2 m -62.73 -15.27 52.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.44 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 61.9 m-70 -114.91 -25.76 8.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 174.049 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.707 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 58.7 t -66.3 -60.77 2.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.525 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -71.22 119.12 14.9 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.908 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -75.44 122.22 23.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.495 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -140.2 -75.36 0.34 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.903 0.383 . . . . 0.0 109.991 178.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.81 17.11 20.11 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 122.029 0.918 . . . . 0.0 108.776 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.37 -169.42 40.55 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.949 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.2 m -155.51 -77.57 0.09 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -62.75 -47.79 81.99 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 175.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -82.99 144.91 29.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.513 -1.221 . . . . 0.0 108.773 173.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -81.99 119.51 75.31 Favored Pre-proline 0 CA--C 1.502 -0.882 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.41 -176.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.69 ' HD2' ' O ' ' A' ' 98' ' ' THR . 57.3 Cg_endo -74.99 71.73 4.89 Favored 'Trans proline' 0 N--CA 1.443 -1.466 0 C-N-CA 121.273 1.315 . . . . 0.0 111.82 174.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.67 76.15 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.669 0.747 . . . . 0.0 110.623 170.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 22.5 ptt? -89.55 -59.23 2.27 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.398 -177.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.7 m -163.04 117.49 1.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.482 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.47 -35.29 65.36 Favored 'General case' 0 C--O 1.219 -0.504 0 O-C-N 123.739 0.649 . . . . 0.0 112.03 -174.27 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -65.15 -47.05 78.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.114 0.483 . . . . 0.0 110.53 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.9 -38.62 79.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.682 176.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.429 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.1 tm? -58.0 -39.62 78.71 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.947 177.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 114' ' ' GLU . 39.9 mt -60.6 -46.02 96.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.067 175.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -64.7 -33.49 76.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.298 0.571 . . . . 0.0 110.209 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.3 mp -61.62 -47.92 91.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.437 175.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.855 ' HA ' HG21 ' A' ' 97' ' ' ILE . 70.4 mt -61.92 -43.96 98.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.64 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.653 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.6 t70 -63.08 -39.58 95.12 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.821 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.67 -28.84 60.51 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.911 177.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.826 HG21 HD12 ' A' ' 97' ' ' ILE . 45.5 t -61.8 -51.04 77.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.839 0.352 . . . . 0.0 110.918 174.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.38 -13.07 61.68 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.168 0.509 . . . . 0.0 110.9 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.653 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.6 mtm-85 -94.71 -50.06 5.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.626 -177.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -125.58 -31.61 2.96 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -173.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.549 ' CB ' ' HA ' ' A' ' 124' ' ' VAL . 9.6 t0 -75.14 -23.43 57.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.177 0.513 . . . . 0.0 110.637 -174.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.07 103.97 4.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 167.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -81.79 -18.66 43.33 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.417 -174.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ASN . . . . . 0.486 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.1 m120 -83.3 -14.23 53.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.234 -172.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 131' ' ' ASN . 26.8 m-80 67.59 34.42 4.57 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.811 0.694 . . . . 0.0 110.365 -173.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.486 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -102.01 -21.36 14.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.8 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.27 4.61 77.29 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.466 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.487 ' HB2' HD22 ' A' ' 87' ' ' LEU . 59.6 m-85 -127.65 167.84 15.86 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.621 HG22 ' HB2' ' A' ' 88' ' ' LEU . 4.6 tt -107.86 122.69 62.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.93 0.872 . . . . 0.0 110.498 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -95.48 166.46 11.85 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.364 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.814 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 14.9 t80 -48.37 -47.68 37.21 Favored 'General case' 0 CA--C 1.523 -0.07 0 O-C-N 123.065 0.228 . . . . 0.0 110.869 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.386 -178.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.02 -50.27 64.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.89 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.814 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.2 p90 -74.03 -34.27 64.05 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.71 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.57 84.55 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.993 0.425 . . . . 0.0 110.239 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -72.2 -31.61 66.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.094 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 41.6 t -84.59 -37.04 21.63 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.367 -173.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.803 HD21 ' HG2' ' A' ' 73' ' ' GLN . 3.5 pp -80.54 -21.96 41.3 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.943 0.401 . . . . 0.0 110.963 -176.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.393 -0.813 . . . . 0.0 110.363 178.866 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.514 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 97.6 mmm . . . . . 0 N--CA 1.463 0.2 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.812 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 2.9 p -95.46 170.04 8.37 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.664 -0.207 . . . . 0.0 110.939 179.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.812 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 33.6 Cg_endo -61.9 -37.77 63.55 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.356 2.037 . . . . 0.0 114.252 -164.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -54.55 45.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.153 -174.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -76.46 -28.83 56.69 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.003 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.514 ' CD2' ' HB2' ' A' ' 67' ' ' MET . 12.1 mt -63.21 -19.81 64.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.653 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -71.75 -45.42 61.75 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.37 -23.93 67.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.71 172.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.486 ' O ' ' HB2' ' A' ' 79' ' ' MET . 11.0 t-80 -66.94 -39.78 87.39 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.787 176.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.841 ' HE1' HD21 ' A' ' 145' ' ' LEU . 5.2 m-30 -69.21 -25.65 64.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.264 0.554 . . . . 0.0 110.024 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.672 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 44.3 t80 -75.39 -54.23 7.4 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.819 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.672 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.9 mmmt -81.03 -17.38 50.43 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.486 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -45.74 -25.75 0.54 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.103 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.816 ' HE1' HD23 ' A' ' 93' ' ' LEU . 0.2 OUTLIER -157.93 9.56 0.17 Allowed 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.003 -165.385 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.548 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 27.8 t70 -89.12 61.78 5.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.736 0.779 . . . . 0.0 109.627 -176.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.438 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 11.6 m-85 -76.44 -24.13 53.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.932 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -70.34 -14.49 62.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.998 -174.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 63.13 28.14 71.67 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.85 -0.614 . . . . 0.0 113.218 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -96.76 -2.78 43.62 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 117.465 0.633 . . . . 0.0 110.396 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 59.11 34.98 23.63 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.519 HD22 ' HB2' ' A' ' 135' ' ' TYR . 7.6 mt -150.9 155.87 40.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.403 177.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.605 ' HB2' HG22 ' A' ' 136' ' ' ILE . 2.3 mm? -114.48 112.04 22.35 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.567 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 12.7 t70 -82.9 161.98 21.7 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 173.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.5 ' HA2' ' HB2' ' A' ' 93' ' ' LEU . . . -54.93 -32.73 56.2 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.103 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.567 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 32.1 mt -59.73 -49.02 79.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.972 0.415 . . . . 0.0 110.31 178.519 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.548 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.6 mt-10 -63.28 -50.2 71.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.692 0.758 . . . . 0.0 109.15 173.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.816 HD23 ' HE1' ' A' ' 80' ' ' HIS . 46.2 mt -58.96 -15.11 11.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.548 -1.205 . . . . 0.0 113.432 -171.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.885 ' HA ' HD13 ' A' ' 121' ' ' ILE . 65.4 p -52.21 -33.68 42.19 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.294 0.371 . . . . 0.0 111.865 -178.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.39 -31.34 16.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.591 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -94.93 -33.51 12.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -170.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.815 HD12 HG21 ' A' ' 124' ' ' VAL . 31.1 mm -63.67 -18.08 21.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.28 0.562 . . . . 0.0 110.283 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.695 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 2.6 m -60.01 -14.85 18.21 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.683 172.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -115.81 -39.99 3.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.706 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.6 t -60.54 -53.59 46.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.984 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -76.3 71.1 2.98 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 172.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.636 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 1.6 pptp? -57.58 128.94 39.6 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.834 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -123.22 -63.45 1.25 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.874 -178.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.673 ' HG2' ' HB3' ' A' ' 110' ' ' PRO . 9.3 pt-20 -89.73 -31.77 17.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.769 0.318 . . . . 0.0 110.85 176.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.443 ' HA3' ' HG2' ' A' ' 108' ' ' GLN . . . -157.62 172.33 34.91 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.021 -0.609 . . . . 0.0 111.579 178.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 5.5 m -87.5 -55.22 3.89 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.619 0.21 . . . . 0.0 111.153 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -68.47 -56.51 8.16 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.271 0.558 . . . . 0.0 109.53 176.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.443 ' HG2' ' HA3' ' A' ' 105' ' ' GLY . 19.2 pt20 -60.72 154.27 22.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.682 -1.144 . . . . 0.0 111.799 -172.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -100.06 115.96 65.03 Favored Pre-proline 0 N--CA 1.443 -0.777 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.395 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.695 ' HD2' ' O ' ' A' ' 98' ' ' THR . 39.2 Cg_endo -69.86 60.58 1.74 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.373 2.048 . . . . 0.0 111.665 172.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.49 77.53 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 121.931 0.872 . . . . 0.0 109.528 175.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.458 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.5 ptt? -83.52 -53.71 5.49 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.982 -1.463 . . . . 0.0 109.891 178.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 58.3 m -164.42 131.97 3.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 175.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.537 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.5 OUTLIER -61.85 -33.65 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.54 -173.695 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -70.51 -40.41 73.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 110.388 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -67.76 -37.72 82.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.653 HD21 HG23 ' A' ' 98' ' ' THR . 9.4 tp -62.02 -42.06 98.76 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.149 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.7 mt -56.71 -41.64 75.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.932 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -72.49 -33.82 67.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.722 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.02 -36.34 76.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 177.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.885 HD13 ' HA ' ' A' ' 94' ' ' SER . 86.5 mt -65.26 -44.4 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.016 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.753 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 35.0 t70 -63.2 -36.82 84.89 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.02 -32.0 59.2 Favored Glycine 0 C--N 1.332 0.334 0 N-CA-C 111.655 -0.578 . . . . 0.0 111.655 174.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.815 HG21 HD12 ' A' ' 97' ' ' ILE . 49.5 t -64.76 -49.16 81.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.883 0.373 . . . . 0.0 110.154 173.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.52 -10.62 36.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.295 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.753 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 29.2 mtm180 -99.09 -48.3 4.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.482 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -118.91 -37.25 3.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.547 ' HB2' HG13 ' A' ' 124' ' ' VAL . 17.5 m-20 -75.15 -19.64 59.77 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.02 0.438 . . . . 0.0 110.869 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.414 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 0.7 OUTLIER -79.45 94.23 5.52 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 167.281 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -79.47 -20.47 47.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.368 -172.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -82.68 -15.37 52.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.414 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 13.8 m120 62.64 37.96 12.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.277 -171.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -103.98 -5.6 22.05 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.36 -18.84 50.49 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.109 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.519 ' HB2' HD22 ' A' ' 87' ' ' LEU . 29.3 m-85 -115.74 166.31 12.09 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 116.983 0.392 . . . . 0.0 110.367 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.605 HG22 ' HB2' ' A' ' 88' ' ' LEU . 8.5 tt -103.4 121.93 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 CA-C-O 121.855 0.836 . . . . 0.0 109.727 176.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.79 172.13 7.25 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.492 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.866 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 19.1 t80 -51.08 -47.37 61.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.28 0.363 . . . . 0.0 110.969 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.5 71.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.373 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -81.34 -50.82 9.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.819 -171.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.866 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -70.22 -34.55 73.03 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.832 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.501 ' HA ' HD12 ' A' ' 145' ' ' LEU . . . -68.07 -31.56 71.28 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.006 0.432 . . . . 0.0 110.465 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -76.68 -27.9 55.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.04 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.0 t -78.5 -18.69 54.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.841 HD21 ' HE1' ' A' ' 76' ' ' TYR . 76.8 mt -86.82 -45.37 10.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.562 176.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.303 -178.261 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.63 ' HB2' HD21 ' A' ' 72' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.369 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.549 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 50.6 m -84.05 157.46 62.89 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.959 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.38 -45.66 36.07 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.101 2.534 . . . . 0.0 114.283 -172.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -64.15 -43.59 94.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.821 -171.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.549 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 2.5 pm0 -77.06 -26.46 53.56 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.372 174.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.63 HD21 ' HB2' ' A' ' 67' ' ' MET . 13.2 mt -63.21 -21.53 66.28 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.511 ' HG2' HD21 ' A' ' 145' ' ' LEU . 24.6 mt-30 -68.89 -44.99 72.09 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.49 -19.05 65.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.583 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.557 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 14.7 t-80 -69.55 -34.15 73.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.373 -0.376 . . . . 0.0 109.992 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.706 ' CD2' HG22 ' A' ' 100' ' ' VAL . 5.1 m-30 -72.06 -27.83 62.94 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.568 ' O ' HD11 ' A' ' 88' ' ' LEU . 34.6 t80 -73.69 -52.66 12.52 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.738 176.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.55 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.28 -13.03 59.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -175.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.461 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 2.2 tpt -45.57 -38.26 6.29 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.173 0.589 . . . . 0.0 112.285 -173.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.413 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -143.04 11.14 1.77 Allowed 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.041 -178.495 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.745 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 35.1 t70 -79.74 84.33 5.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.648 0.737 . . . . 0.0 110.557 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -119.02 22.59 11.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.183 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.7 p30 -110.86 -14.11 14.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.769 -174.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 68.79 25.9 74.9 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.079 -0.51 . . . . 0.0 113.107 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -101.03 -1.95 32.92 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 117.46 0.63 . . . . 0.0 111.371 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 63.21 27.33 15.53 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.172 176.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.608 HD22 ' HB2' ' A' ' 135' ' ' TYR . 15.5 mt -153.27 167.61 28.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.461 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.568 HD11 ' O ' ' A' ' 77' ' ' PHE . 3.0 mm? -124.39 121.81 35.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.356 -179.009 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.568 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.2 p-10 -104.52 -179.25 3.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.83 -36.79 33.91 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 114.201 0.44 . . . . 0.0 114.201 -177.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.568 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 30.8 mt -64.3 -53.44 48.8 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.321 0.582 . . . . 0.0 110.552 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.745 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 41.6 mt-10 -62.95 -47.98 80.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.916 178.017 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.818 ' HB3' HG12 ' A' ' 97' ' ' ILE . 37.9 mt -66.23 -10.68 44.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.98 -174.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.974 ' HA ' HD13 ' A' ' 121' ' ' ILE . 24.0 t -56.4 -34.52 66.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.734 0.302 . . . . 0.0 110.845 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.9 m -92.22 -28.57 16.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.239 0.542 . . . . 0.0 111.569 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.538 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -83.72 -47.13 11.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.739 -171.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.892 HD12 HG21 ' A' ' 124' ' ' VAL . 33.8 mm -60.14 -20.84 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.383 -175.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.827 HG22 ' HB1' ' A' ' 109' ' ' ALA . 8.9 m -51.02 -30.55 15.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.971 174.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.472 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 68.5 m-70 -103.82 -33.07 9.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.687 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.706 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.5 t -68.06 -51.74 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.478 -173.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -74.67 89.11 2.23 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.7 pptp? -103.25 154.98 18.78 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -165.58 -46.91 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.167 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.5 mm-40 -95.49 42.28 1.09 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.861 173.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.36 -144.7 6.25 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -177.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 2.9 t -146.19 -78.84 0.17 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -115.07 0.5 13.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.293 1.044 . . . . 0.0 109.701 174.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -89.74 150.29 22.37 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.399 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.827 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -83.19 117.34 68.3 Favored Pre-proline 0 CA--C 1.508 -0.654 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.978 -176.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.11 63.3 8.21 Favored 'Trans proline' 0 N--CA 1.445 -1.36 0 C-N-CA 121.886 1.724 . . . . 0.0 111.05 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.4 89.63 0.01 OUTLIER 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.837 0.827 . . . . 0.0 111.402 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.431 ' HG3' ' H ' ' A' ' 113' ' ' SER . 13.2 ptt? -93.48 -59.06 2.1 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.001 178.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.431 ' H ' ' HG3' ' A' ' 112' ' ' MET . 74.9 m -164.63 123.93 1.88 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 178.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.625 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.1 OUTLIER -54.04 -34.97 61.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.87 -174.788 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.465 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 21.2 t70 -71.36 -42.68 68.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.948 0.404 . . . . 0.0 110.666 -178.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.02 -38.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.859 0.838 . . . . 0.0 108.93 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.679 HD21 HG23 ' A' ' 98' ' ' THR . 9.5 tp -61.25 -37.1 81.88 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.333 177.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.625 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.0 mt -57.13 -43.7 81.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.474 175.484 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -65.49 -39.29 91.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.464 0.65 . . . . 0.0 109.607 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -61.46 -41.44 90.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.008 -0.996 . . . . 0.0 111.171 178.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.974 HD13 ' HA ' ' A' ' 94' ' ' SER . 90.1 mt -65.26 -38.58 82.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.953 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.796 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.8 t70 -63.7 -42.14 98.02 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.35 -32.0 57.25 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.368 176.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.892 HG21 HD12 ' A' ' 97' ' ' ILE . 46.5 t -61.82 -47.88 91.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.949 0.404 . . . . 0.0 110.215 174.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 66.3 mt -67.61 -7.45 26.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.82 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.796 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 22.5 mtp85 -103.48 -47.21 4.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.744 -178.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -112.7 -48.83 2.98 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.6 ' HB2' HG13 ' A' ' 124' ' ' VAL . 20.9 m-20 -68.84 -22.37 64.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.123 -174.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.595 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 6.1 t70 -76.35 80.3 3.1 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.55 -17.96 63.61 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 114.649 -1.159 . . . . 0.0 111.844 -169.09 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -116.85 10.23 14.1 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.928 -172.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.595 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 17.9 m120 53.63 44.63 29.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.579 173.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -99.13 -13.09 19.94 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.199 176.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.02 4.17 78.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.128 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.608 ' HB2' HD22 ' A' ' 87' ' ' LEU . 34.4 m-85 -133.65 176.68 8.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.427 HG23 ' HD1' ' A' ' 141' ' ' PHE . 8.3 tt -117.6 119.62 62.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.359 0.6 . . . . 0.0 109.73 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -97.53 -178.67 4.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.823 177.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.763 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.5 t80 -56.03 -47.92 76.93 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 123.44 0.463 . . . . 0.0 111.058 -173.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.99 66.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.959 0.409 . . . . 0.0 111.548 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.575 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 50.9 mt-10 -74.27 -53.87 8.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.849 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.763 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.8 p90 -72.84 -28.83 62.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.876 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.39 81.48 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 110.393 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -73.91 -32.16 63.42 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.025 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.453 ' HB3' HG12 ' A' ' 100' ' ' VAL . 9.0 t -81.3 -38.81 26.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.039 -171.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.511 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.3 pp -82.58 -13.01 57.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.646 -175.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.862 -179.462 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.526 ' HB2' HD21 ' A' ' 72' ' ' LEU . 95.9 mmm . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.664 0.269 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.446 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 9.0 m -82.4 157.74 67.32 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.428 -178.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.551 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 75.0 Cg_exo -50.76 -48.94 18.43 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.902 2.401 . . . . 0.0 114.255 -173.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -59.92 -49.5 77.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.446 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 5.3 pm0 -71.7 -28.92 64.03 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.737 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.526 HD21 ' HB2' ' A' ' 67' ' ' MET . 11.3 mt -64.27 -21.28 66.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.371 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 24.1 mt-30 -69.57 -46.31 66.68 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 49.1 tp -65.15 -20.91 66.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.896 173.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 15.4 t-80 -69.67 -43.3 72.81 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 76' ' ' TYR . 4.2 m-30 -65.69 -25.16 67.19 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.618 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 45.1 t80 -75.6 -53.56 8.4 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.039 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.618 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.3 mmmt -79.9 -30.88 40.22 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -173.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 17.3 tpp -47.93 -36.29 12.14 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -170.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.832 ' HE1' HD23 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -135.2 8.37 3.43 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -169.015 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.667 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.0 t70 -88.51 73.03 8.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.016 0.913 . . . . 0.0 109.354 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -72.08 -22.37 61.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.313 -175.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -87.06 -15.89 37.24 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.533 -175.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.418 ' HA2' ' OD1' ' A' ' 81' ' ' ASP . . . 62.58 29.69 74.35 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 115.545 -0.752 . . . . 0.0 114.401 175.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -94.19 6.87 47.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 117.783 0.791 . . . . 0.0 111.464 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 69.79 13.65 8.06 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.839 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.546 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.2 mm? -131.16 152.44 50.44 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.09 0.472 . . . . 0.0 110.309 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.681 HD22 ' CD2' ' A' ' 80' ' ' HIS . 14.5 mt -119.94 109.16 15.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.612 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.618 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 11.1 t70 -75.3 160.93 29.76 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.502 ' HA2' ' HB2' ' A' ' 93' ' ' LEU . . . -53.4 -29.5 38.64 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 121.29 -0.481 . . . . 0.0 112.386 174.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.618 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.8 mt -60.35 -55.26 35.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 110.085 175.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.667 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 34.7 mt-10 -59.37 -53.02 62.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.207 174.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.832 HD23 ' HE1' ' A' ' 80' ' ' HIS . 69.1 mt -55.59 -17.07 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.897 -172.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.902 ' HA ' HD13 ' A' ' 121' ' ' ILE . 15.8 t -52.48 -32.01 37.83 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.362 0.414 . . . . 0.0 111.912 -177.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -29.4 17.43 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.533 ' HB3' ' CE1' ' A' ' 80' ' ' HIS . . . -98.13 -28.07 13.9 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -168.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.723 ' CG1' ' HB3' ' A' ' 93' ' ' LEU . 34.5 mm -66.52 -17.08 21.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.671 0.748 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.812 HG23 HD21 ' A' ' 117' ' ' LEU . 5.6 m -63.22 -17.2 62.18 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.735 172.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.58 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 98.9 m-70 -112.46 -21.41 11.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.074 0.464 . . . . 0.0 110.088 174.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.691 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.1 t -77.76 -59.39 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.149 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.54 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.4 t60 -80.09 74.05 6.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.399 0.619 . . . . 0.0 109.811 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.611 ' HB2' ' O ' ' A' ' 105' ' ' GLY . 10.1 ptmm? -58.91 153.48 17.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.152 -176.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -142.12 -76.41 0.28 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.62 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.827 ' HG2' ' HB3' ' A' ' 110' ' ' PRO . 7.5 pt-20 -67.64 -44.46 77.89 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.172 0.51 . . . . 0.0 110.444 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.611 ' O ' ' HB2' ' A' ' 102' ' ' LYS . . . -130.91 -155.27 8.17 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 175.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 3.3 p -97.06 -84.48 0.37 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 117.327 0.563 . . . . 0.0 111.139 177.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.2 mp0 -76.71 -22.29 54.1 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 120.814 0.34 . . . . 0.0 111.523 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -69.84 127.11 31.75 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.928 0.394 . . . . 0.0 110.679 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.58 ' HB2' ' CE1' ' A' ' 99' ' ' HIS . . . -66.98 117.85 49.67 Favored Pre-proline 0 CA--C 1.504 -0.815 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.791 -176.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.827 ' HB3' ' HG2' ' A' ' 104' ' ' GLU . 1.1 Cg_endo -83.34 68.73 7.14 Favored 'Trans proline' 0 N--CA 1.432 -2.089 0 C-N-CA 121.708 1.605 . . . . 0.0 111.287 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.07 74.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.049 0.928 . . . . 0.0 110.28 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.484 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.3 ptt? -90.88 -50.75 5.71 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.597 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -159.4 125.45 4.37 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.537 ' O ' HG13 ' A' ' 118' ' ' ILE . 11.5 pt-20 -57.14 -41.88 79.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.391 -176.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -66.34 -50.28 64.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.979 0.418 . . . . 0.0 110.286 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.05 -41.32 78.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.245 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.812 HD21 HG23 ' A' ' 98' ' ' THR . 9.0 tp -63.76 -36.95 85.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 114' ' ' GLU . 87.6 mt -60.57 -44.0 95.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.231 174.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -66.47 -32.26 73.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.047 0.451 . . . . 0.0 110.459 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.54 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.64 -39.01 78.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.572 174.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.902 HD13 ' HA ' ' A' ' 94' ' ' SER . 46.3 mt -74.98 -19.26 16.35 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 CA-C-O 121.191 0.519 . . . . 0.0 110.591 177.506 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.687 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 30.2 t70 -74.11 -41.08 62.18 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.6 -35.92 63.31 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 114.588 -1.187 . . . . 0.0 113.211 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.836 HG13 HD12 ' A' ' 125' ' ' LEU . 7.2 p -62.56 -47.17 94.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 CA-C-N 117.529 0.664 . . . . 0.0 110.533 178.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.836 HD12 HG13 ' A' ' 124' ' ' VAL . 5.4 mp -70.44 -11.81 61.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.847 0.356 . . . . 0.0 111.379 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.687 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 20.2 mtm180 -92.92 -49.28 6.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -125.8 -26.8 3.43 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.67 ' HB2' HG23 ' A' ' 124' ' ' VAL . 41.8 m-20 -79.14 -28.47 42.83 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.685 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.5 96.41 3.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.578 0.704 . . . . 0.0 109.367 171.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -80.85 -18.75 46.36 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.768 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -78.58 -15.76 58.19 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.062 0.458 . . . . 0.0 110.16 -176.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 66.0 t30 59.67 33.28 21.88 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.601 -173.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -97.88 -16.8 19.6 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.275 -178.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.69 -34.62 5.46 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.687 178.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.546 ' HB2' HD12 ' A' ' 87' ' ' LEU . 6.9 m-85 -114.73 168.84 9.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.46 0.63 . . . . 0.0 111.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.668 HG22 HD12 ' A' ' 88' ' ' LEU . 0.2 OUTLIER -95.59 127.48 47.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.333 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -176.44 3.08 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.255 169.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.797 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.3 t80 -55.4 -48.09 74.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.569 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.22 -27.35 68.61 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.502 ' OE2' ' HA ' ' A' ' 136' ' ' ILE . 56.6 mt-10 -81.66 -47.93 12.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.79 -173.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.797 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.1 p90 -71.13 -30.44 66.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.494 176.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.27 86.47 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.514 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.46 -29.15 52.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.618 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 22.7 t -80.11 -33.94 38.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.398 -172.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.5 pp -79.2 -5.11 53.51 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.842 0.353 . . . . 0.0 111.41 -178.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.51 -0.757 . . . . 0.0 111.274 -177.248 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.767 ' HB2' HD11 ' A' ' 72' ' ' LEU . 93.0 mmm . . . . . 0 C--O 1.232 0.149 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.425 ' O ' HD13 ' A' ' 72' ' ' LEU . 16.2 m -83.32 155.52 66.46 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.41 -41.36 43.63 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 123.022 2.481 . . . . 0.0 114.152 -172.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 73' ' ' GLN . 12.2 pt20 -57.56 -39.67 77.2 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.039 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.415 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 4.4 mm-40 -67.72 -44.83 76.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.84 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 10.0 mp -61.29 -21.85 64.32 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.075 -168.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.41 ' NE2' ' HA ' ' A' ' 70' ' ' GLN . 18.5 mt-30 -62.85 -49.68 73.91 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HG ' ' HG2' ' A' ' 78' ' ' LYS . 28.1 tp -68.03 -24.31 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.911 174.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.84 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.4 t60 -67.07 -41.54 86.25 Favored 'General case' 0 C--O 1.225 -0.198 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.733 ' CD1' HG22 ' A' ' 100' ' ' VAL . 4.4 m-30 -72.4 -38.04 68.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.634 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.621 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 51.8 t80 -63.66 -51.55 64.62 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.69 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.614 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 23.7 mmmt -79.01 -19.12 52.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.2 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 16.8 tpp -44.16 -50.44 8.67 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.954 0.784 . . . . 0.0 112.203 -173.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -130.0 9.97 5.39 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.414 -0.515 . . . . 0.0 111.549 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.699 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.3 t70 -82.46 72.19 9.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.689 0.757 . . . . 0.0 110.09 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.1 13.58 30.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.059 178.563 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.1 p30 -101.65 -13.71 17.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.835 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 65.18 32.0 82.48 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.561 -0.745 . . . . 0.0 113.3 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -107.52 -4.54 18.3 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.597 0.698 . . . . 0.0 111.763 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.1 m120 68.37 12.31 8.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.027 0.531 . . . . 0.0 112.255 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.564 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -128.54 164.71 22.22 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.562 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 65.7 mt -126.32 119.26 26.9 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.235 174.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.49 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.3 p30 -99.0 -176.72 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 175.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.21 -36.6 52.86 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.758 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.49 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 46.4 mt -63.52 -47.24 82.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.178 0.513 . . . . 0.0 110.29 -177.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.699 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 36.6 mt-10 -69.12 -49.95 52.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.742 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.797 ' HB3' HG12 ' A' ' 97' ' ' ILE . 35.1 mt -63.94 -14.7 55.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.263 -173.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.779 ' HA ' HD13 ' A' ' 121' ' ' ILE . 79.7 p -56.51 -37.54 70.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.859 0.361 . . . . 0.0 111.008 -178.175 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -91.71 -27.15 18.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.348 0.594 . . . . 0.0 111.141 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.627 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -82.27 -48.51 11.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.605 -172.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.933 HG21 ' HA ' ' A' ' 121' ' ' ILE . 30.4 mm -59.66 -25.75 32.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.954 -174.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.694 HG23 HD21 ' A' ' 117' ' ' LEU . 20.9 m -55.94 -22.23 25.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.132 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.522 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 90.4 m-70 -110.8 -11.43 14.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.499 177.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.733 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.7 t -95.1 -49.42 12.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -175.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.575 ' CD2' HG13 ' A' ' 120' ' ' ILE . 69.8 t60 -73.31 98.54 2.7 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.308 -174.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.459 ' HD2' ' O ' ' A' ' 144' ' ' SER . 0.0 OUTLIER -59.12 134.17 56.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.654 171.778 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -162.14 -74.79 0.05 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -88.58 -57.71 2.82 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -100.06 -157.57 28.25 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 170.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.434 ' HB2' ' OE1' ' A' ' 107' ' ' GLU . 10.8 m -139.37 -84.99 0.24 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 117.147 0.474 . . . . 0.0 109.863 176.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.434 ' OE1' ' HB2' ' A' ' 106' ' ' SER . 2.7 mp0 -70.55 -49.81 44.11 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.424 0.63 . . . . 0.0 109.979 175.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -68.84 140.17 55.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.741 178.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.658 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -75.48 117.48 63.65 Favored Pre-proline 0 CA--C 1.503 -0.849 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.904 -173.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -84.03 68.95 6.58 Favored 'Trans proline' 0 N--CA 1.431 -2.153 0 C-N-CA 121.288 1.326 . . . . 0.0 111.241 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.63 80.23 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 122.115 0.96 . . . . 0.0 110.782 172.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.483 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.1 ptt? -92.86 -58.03 2.46 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.315 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.9 m -159.68 122.11 3.43 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.609 ' O ' HG13 ' A' ' 118' ' ' ILE . 5.0 pm0 -56.44 -34.16 66.56 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.124 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -74.08 -35.23 64.22 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.204 -0.598 . . . . 0.0 110.135 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -68.63 -39.21 80.87 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.694 HD21 HG23 ' A' ' 98' ' ' THR . 11.6 tp -59.92 -39.02 84.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.296 177.41 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.609 HG13 ' O ' ' A' ' 114' ' ' GLU . 95.9 mt -61.22 -44.86 99.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.742 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -65.65 -32.88 74.7 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 109.987 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.575 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.49 -38.68 76.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.537 175.494 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.933 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -68.42 -39.6 81.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.411 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.731 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.5 t70 -61.99 -44.85 95.86 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.119 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.11 -34.4 52.76 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.466 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.813 HG21 HD12 ' A' ' 97' ' ' ILE . 47.3 t -65.04 -48.35 84.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.86 0.362 . . . . 0.0 110.414 175.101 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.447 HD22 ' O ' ' A' ' 134' ' ' GLY . 88.1 mt -67.87 -4.88 14.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.08 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.731 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.4 mtm180 -103.29 -49.21 3.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -120.21 -35.41 3.45 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.656 ' HB2' HG13 ' A' ' 124' ' ' VAL . 26.3 m-20 -78.23 -16.7 57.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.153 0.501 . . . . 0.0 110.288 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.74 90.85 3.44 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -17.04 59.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.731 -167.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -119.94 17.95 12.52 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 54.71 40.23 31.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.442 172.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 p30 -102.53 -11.49 18.49 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.261 177.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.447 ' O ' HD22 ' A' ' 125' ' ' LEU . . . 84.16 1.15 89.63 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.617 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.564 ' HB2' HD12 ' A' ' 87' ' ' LEU . 13.8 m-85 -127.59 178.86 5.83 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.535 HG22 HD21 ' A' ' 93' ' ' LEU . 3.7 tt -121.41 125.53 73.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -103.14 -177.62 3.43 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.104 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.888 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 15.2 t80 -56.66 -48.82 76.76 Favored 'General case' 0 C--O 1.227 -0.128 0 O-C-N 123.3 0.375 . . . . 0.0 110.838 -175.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.19 -21.91 64.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.694 0.283 . . . . 0.0 111.558 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -78.52 -56.78 4.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.888 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -67.63 -32.08 72.54 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.855 -0.738 . . . . 0.0 110.097 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.61 -39.95 78.04 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.953 0.406 . . . . 0.0 110.421 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.3 mtmm -75.34 -28.11 59.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.961 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.459 ' O ' ' HD2' ' A' ' 102' ' ' LYS . 23.2 t -79.21 -19.01 51.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.82 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 68.3 mt -87.12 8.55 23.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.415 178.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.227 -179.607 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.493 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 98.9 mmm . . . . . 0 N--CA 1.464 0.24 0 CA-C-O 121.142 0.496 . . . . 0.0 111.732 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.545 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 17.2 m -93.16 163.41 25.24 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.742 -178.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.578 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.6 Cg_exo -53.34 -49.92 15.76 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.809 2.339 . . . . 0.0 113.969 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.53 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 2.1 pt20 -61.77 -49.94 74.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.068 -176.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 68' ' ' SER . 0.8 OUTLIER -61.27 -43.34 99.03 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.675 175.077 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.55 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 12.3 mt -62.44 -22.85 66.52 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.702 -173.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.838 ' HG2' HD21 ' A' ' 145' ' ' LEU . 95.6 mt-30 -71.3 -39.67 71.32 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 175.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.51 -24.67 65.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.384 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.55 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 59.3 t60 -65.88 -46.43 78.43 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 175.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.458 ' CD1' HD22 ' A' ' 145' ' ' LEU . 3.3 m-30 -63.69 -33.65 76.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.189 0.519 . . . . 0.0 109.64 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.548 ' HA ' HD11 ' A' ' 88' ' ' LEU . 65.2 t80 -65.62 -51.91 56.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.204 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.454 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 27.4 mmmt -79.69 -15.5 57.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.547 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.4 tpt -45.2 -44.29 10.84 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.597 0.759 . . . . 0.0 112.519 -170.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.551 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -137.41 10.29 2.96 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.706 -177.569 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.714 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.1 t70 -83.2 88.69 6.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.243 0.544 . . . . 0.0 110.21 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.453 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 26.7 m-85 -110.46 -0.91 17.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.149 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -87.64 -14.68 39.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.582 -174.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.97 78.0 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 121.162 -0.542 . . . . 0.0 113.425 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -95.41 -5.4 43.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 117.706 0.753 . . . . 0.0 111.311 -177.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 64.84 18.25 11.38 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.177 0.591 . . . . 0.0 112.033 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.591 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -130.4 167.76 18.06 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 172.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.548 HD11 ' HA ' ' A' ' 77' ' ' PHE . 68.1 mt -131.04 117.28 18.93 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.813 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -93.76 -178.93 4.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.143 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -56.68 -33.89 63.64 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.128 -0.558 . . . . 0.0 113.331 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 19.9 mt -69.55 -48.38 60.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.176 0.512 . . . . 0.0 109.932 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.714 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 45.6 mt-10 -62.99 -49.24 75.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.886 0.85 . . . . 0.0 109.39 174.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.805 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.2 mt -66.57 -9.84 39.31 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.924 -1.034 . . . . 0.0 113.407 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' SER . . . . . 1.03 ' HA ' HD13 ' A' ' 121' ' ' ILE . 34.6 t -54.57 -31.64 57.03 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.024 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.05 -36.75 13.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 0.0 111.339 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.49 -39.26 22.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.845 -168.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.805 HG12 ' HB3' ' A' ' 93' ' ' LEU . 39.1 mm -67.87 -16.33 20.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.959 0.409 . . . . 0.0 111.16 -176.205 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.568 HG23 HD21 ' A' ' 117' ' ' LEU . 8.7 m -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.471 175.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 64.3 m-70 -102.86 -23.72 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.275 174.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.761 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 73.4 t -77.97 -63.8 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.729 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.486 ' CD2' HG13 ' A' ' 120' ' ' ILE . 13.3 t60 -82.84 86.04 6.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.249 0.547 . . . . 0.0 110.324 -176.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.526 ' HE2' ' O ' ' A' ' 144' ' ' SER . 0.0 OUTLIER -111.67 176.71 4.91 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.708 -177.724 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -124.15 -39.82 2.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.684 175.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -122.28 -42.28 2.37 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -80.84 178.82 53.86 Favored Glycine 0 C--O 1.226 -0.371 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.438 -177.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.9 m -131.28 -84.14 0.51 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 173.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -76.93 -2.41 33.52 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.537 0.684 . . . . 0.0 110.3 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -101.95 116.52 32.88 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.909 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.53 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -71.85 118.88 70.68 Favored Pre-proline 0 CA--C 1.507 -0.688 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.302 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -89.41 67.72 2.31 Favored 'Trans proline' 0 N--CA 1.432 -2.132 0 C-N-CA 122.015 1.81 . . . . 0.0 111.177 175.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 52.7 tp -59.0 84.25 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.792 0.806 . . . . 0.0 110.781 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.438 ' H ' ' HG2' ' A' ' 112' ' ' MET . 15.5 ptt? -81.96 -55.95 4.27 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.86 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.9 m -162.09 118.72 2.06 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.564 ' O ' HG13 ' A' ' 118' ' ' ILE . 2.5 pm0 -57.47 -34.82 69.41 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -173.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 16.7 t70 -69.9 -42.6 73.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 109.946 -178.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.32 -37.26 80.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.292 175.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.568 HD21 HG23 ' A' ' 98' ' ' THR . 11.7 tp -61.89 -36.45 81.32 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.956 177.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 114' ' ' GLU . 61.8 mt -57.7 -47.4 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.436 174.081 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -67.14 -27.01 66.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 176.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.496 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -69.66 -38.49 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.695 175.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 1.03 HD13 ' HA ' ' A' ' 94' ' ' SER . 76.1 mt -74.78 -18.29 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.536 0.684 . . . . 0.0 109.806 176.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.665 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 4.5 m-20 -75.35 -42.41 54.27 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 166.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.4 -38.26 68.83 Favored Glycine 0 C--O 1.227 -0.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.037 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.769 HG23 ' HB2' ' A' ' 128' ' ' ASP . 7.5 p -59.34 -49.19 84.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 117.468 0.634 . . . . 0.0 109.765 176.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.5 mt -69.89 -8.39 48.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.221 0.534 . . . . 0.0 111.269 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.665 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 39.7 mmt-85 -100.56 -31.91 11.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.499 -179.498 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.36 -48.9 0.78 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.769 ' HB2' HG23 ' A' ' 124' ' ' VAL . 32.8 m-20 -65.96 -25.99 67.36 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.492 0.663 . . . . 0.0 110.137 -177.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.831 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -72.42 90.8 1.32 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.924 -1.034 . . . . 0.0 108.735 168.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.84 -29.8 50.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.523 -169.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -90.86 -6.05 54.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.333 0.587 . . . . 0.0 111.024 -177.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.831 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 89.1 m-20 55.95 49.46 15.8 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.353 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 p30 -95.22 -8.1 37.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.199 175.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 -1.3 85.49 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.45 177.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.591 ' HB2' HD12 ' A' ' 87' ' ' LEU . 24.1 m-85 -131.42 176.03 8.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 109.983 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.529 HD12 ' CG2' ' A' ' 124' ' ' VAL . 10.1 tt -112.09 118.7 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.796 0.808 . . . . 0.0 110.507 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -93.58 170.65 9.43 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.583 177.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.864 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.2 t80 -46.62 -54.94 8.46 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.061 0.544 . . . . 0.0 111.224 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.19 -25.88 68.54 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.021 0.439 . . . . 0.0 111.839 -176.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.535 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -77.81 -52.76 8.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.937 -175.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.864 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -72.64 -31.07 64.83 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.644 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.76 -40.54 79.98 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.889 0.376 . . . . 0.0 110.791 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -76.94 -29.25 55.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.333 177.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.526 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 22.7 t -82.8 -38.15 23.51 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.025 -170.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.838 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp -77.55 -26.19 50.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.662 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 . . . . . 0 C--O 1.242 0.667 0 CA-C-O 118.845 -0.597 . . . . 0.0 111.44 -176.315 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.644 ' HB2' HD21 ' A' ' 72' ' ' LEU . 88.6 mmm . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.9 p -116.22 159.65 38.85 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 121.348 -0.141 . . . . 0.0 111.168 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.509 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 82.6 Cg_exo -49.33 -39.79 43.66 Favored 'Trans proline' 0 N--CA 1.481 0.741 0 C-N-CA 123.608 2.872 . . . . 0.0 115.511 -169.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.474 ' HA ' HE21 ' A' ' 73' ' ' GLN . 0.0 OUTLIER -57.56 -54.79 42.89 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 121.227 0.537 . . . . 0.0 110.648 -175.543 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -76.99 -27.17 54.62 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.886 177.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.644 HD21 ' HB2' ' A' ' 67' ' ' MET . 14.0 mt -65.57 -17.56 64.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 120.875 0.369 . . . . 0.0 111.502 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.54 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 44.4 mt-30 -71.23 -47.93 54.28 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 171.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.5 -22.49 63.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.016 172.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.555 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 22.8 t-80 -67.15 -37.07 83.15 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.329 176.292 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.539 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 3.8 m-30 -70.34 -34.62 72.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.483 0.659 . . . . 0.0 109.394 177.045 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.692 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 55.5 t80 -67.78 -52.3 38.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.913 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.692 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.2 mmmt -79.34 -14.81 58.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.381 -175.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.483 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.0 OUTLIER -45.33 -38.11 5.46 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 124.052 0.845 . . . . 0.0 111.816 -174.401 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.459 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -142.81 9.52 1.75 Allowed 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.713 178.955 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.502 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.7 t70 -85.21 79.51 9.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.863 0.84 . . . . 0.0 109.829 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 -11.22 24.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.7 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -90.14 -14.71 33.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.526 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.88 24.57 66.82 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.328 -0.851 . . . . 0.0 114.92 171.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -87.67 5.23 40.7 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.545 1.172 . . . . 0.0 111.012 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.542 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 11.3 m120 70.3 5.74 5.47 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.678 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.556 HD12 ' HB2' ' A' ' 135' ' ' TYR . 3.7 mm? -121.22 145.56 47.72 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.296 0.57 . . . . 0.0 109.932 175.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.487 ' HB3' ' HG ' ' A' ' 93' ' ' LEU . 3.6 mm? -107.44 110.71 22.73 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.149 174.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.588 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.4 p30 -84.64 -174.1 5.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.189 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.08 -47.43 66.94 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.093 0.397 . . . . 0.0 114.093 -176.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.658 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.8 pp -77.14 -28.16 54.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.599 0.699 . . . . 0.0 110.641 -175.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.658 ' N ' HD12 ' A' ' 91' ' ' LEU . 45.5 mt-10 -65.98 -55.08 18.57 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 172.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.939 ' HB3' HG12 ' A' ' 97' ' ' ILE . 32.7 mt -64.21 -12.58 42.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.198 -178.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.719 ' HA ' HD13 ' A' ' 121' ' ' ILE . 39.4 m -55.12 -34.13 63.45 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.595 0.236 . . . . 0.0 111.617 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -92.81 -31.49 15.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.19 0.519 . . . . 0.0 111.225 174.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.456 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . . . -80.04 -42.31 24.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.222 -170.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.939 HG12 ' HB3' ' A' ' 93' ' ' LEU . 41.2 mm -62.7 -25.2 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 111.055 -176.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.624 HG22 ' HB1' ' A' ' 109' ' ' ALA . 2.7 m -58.69 -18.61 32.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.58 176.32 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 72.9 m-70 -115.51 -33.47 5.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.369 172.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.873 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 39.1 t -58.91 -55.46 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 40.2 t60 -74.32 80.4 1.85 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.436 0.636 . . . . 0.0 110.348 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.447 ' HE3' ' O ' ' A' ' 106' ' ' SER . 79.0 tttt -57.66 134.85 56.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.55 -1.205 . . . . 0.0 111.271 -178.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -154.31 -66.56 0.14 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.521 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -80.3 -64.97 1.07 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.063 -174.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.47 ' HA3' ' HG2' ' A' ' 108' ' ' GLN . . . -104.85 -166.41 24.23 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.894 -175.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.447 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 37.6 t -73.67 -75.07 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -118.83 -6.33 10.57 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.42 0.628 . . . . 0.0 110.087 177.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.47 ' HG2' ' HA3' ' A' ' 105' ' ' GLY . 6.3 pt20 -61.6 156.69 19.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.589 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.624 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -85.14 114.34 55.49 Favored Pre-proline 0 CA--C 1.507 -0.698 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.491 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.442 ' HD3' ' O ' ' A' ' 108' ' ' GLN . 4.4 Cg_exo -74.48 61.38 5.2 Favored 'Trans proline' 0 N--CA 1.448 -1.203 0 C-N-CA 121.904 1.736 . . . . 0.0 110.848 172.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.8 tp -71.67 74.54 0.82 Allowed 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 122.185 0.993 . . . . 0.0 110.578 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.472 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.0 ptt? -75.61 -53.61 8.31 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.268 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.0 m -159.86 122.9 3.52 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 175.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.57 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -61.09 -33.97 74.2 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -170.179 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.61 -40.71 76.46 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.215 0.531 . . . . 0.0 110.37 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.0 tt0 -68.85 -36.69 78.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.848 0.832 . . . . 0.0 109.56 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.49 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.4 tm? -63.94 -36.81 85.17 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.612 177.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.57 HG13 ' O ' ' A' ' 114' ' ' GLU . 70.1 mt -62.52 -38.95 82.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.669 174.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -64.5 -40.45 95.67 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 174.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.64 -39.35 79.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.595 175.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.878 ' HA ' HG21 ' A' ' 97' ' ' ILE . 76.0 mt -59.85 -47.91 89.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.284 175.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.782 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 34.7 t70 -61.49 -39.89 92.58 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.66 -31.21 52.97 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.873 175.073 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.847 HG21 HD12 ' A' ' 97' ' ' ILE . 42.9 t -68.25 -49.22 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.291 -0.262 . . . . 0.0 110.291 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 134' ' ' GLY . 8.8 mp -63.63 -10.34 18.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.018 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.782 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 24.2 mtm-85 -102.31 -49.24 3.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -113.45 -45.1 3.15 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -172.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.609 ' HB2' HG13 ' A' ' 124' ' ' VAL . 10.1 m-20 -68.91 -24.09 64.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.898 0.38 . . . . 0.0 110.682 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.564 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.9 t70 -74.68 93.52 2.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.88 0.847 . . . . 0.0 108.962 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -79.08 -18.88 52.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.167 -172.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -2.35 43.9 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.202 -171.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.3 t30 60.64 32.91 20.4 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.389 -177.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -99.0 -1.98 38.45 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 121.061 0.458 . . . . 0.0 110.067 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.451 ' O ' ' HG ' ' A' ' 125' ' ' LEU . . . 82.02 -24.42 4.65 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.735 -0.666 . . . . 0.0 113.35 173.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.556 ' HB2' HD12 ' A' ' 87' ' ' LEU . 18.5 m-85 -116.48 -179.19 3.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.932 0.396 . . . . 0.0 110.59 -176.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.714 HG12 ' HG3' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -110.82 129.73 65.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.388 0.613 . . . . 0.0 112.091 179.206 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.474 ' H ' ' HG2' ' A' ' 140' ' ' GLU . 12.2 t70 -103.11 168.09 9.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.473 172.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.876 ' HA ' ' CE2' ' A' ' 141' ' ' PHE . 21.5 t80 -50.86 -44.05 59.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.718 0.294 . . . . 0.0 110.834 -177.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.443 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -67.81 -31.31 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -173.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.714 ' HG3' HG12 ' A' ' 136' ' ' ILE . 12.7 pt-20 -91.19 -30.06 16.88 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.508 -169.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.876 ' CE2' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -76.11 -32.06 58.99 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.21 171.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.53 ' O ' ' HG2' ' A' ' 146' ' ' GLN . . . -64.13 -43.02 96.57 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.407 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.0 mtmt -72.77 -28.78 62.81 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.351 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.3 t -70.04 -35.15 74.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.943 0.401 . . . . 0.0 110.274 -177.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.448 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.3 pp -86.22 10.77 13.66 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.475 -177.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.53 ' HG2' ' O ' ' A' ' 142' ' ' ALA . 15.5 mm100 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.335 -0.841 . . . . 0.0 110.425 177.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.823 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.2 mmm . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.718 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 26.6 m -98.4 139.4 21.15 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-O 120.997 0.427 . . . . 0.0 110.625 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.768 ' HA ' ' HB2' ' A' ' 72' ' ' LEU . 73.3 Cg_exo -50.92 -27.97 22.49 Favored 'Trans proline' 0 N--CA 1.477 0.51 0 C-N-CA 124.085 3.19 . . . . 0.0 115.15 -172.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -65.06 -51.32 62.18 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-O 120.731 0.301 . . . . 0.0 111.017 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.718 ' HG2' ' O ' ' A' ' 68' ' ' SER . 3.0 pm0 -72.33 -26.36 61.9 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.09 173.316 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.823 HD21 ' HB2' ' A' ' 67' ' ' MET . 39.5 mt -66.82 -17.5 64.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.688 0.28 . . . . 0.0 111.627 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 42.4 mt-30 -73.08 -40.97 64.58 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 171.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.2 tp -66.88 -21.88 65.99 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 171.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.582 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 5.0 t60 -66.91 -35.0 79.01 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.103 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.591 ' OH ' ' HA ' ' A' ' 107' ' ' GLU . 4.0 m-30 -72.1 -33.58 67.97 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.552 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 54.3 t80 -67.09 -53.08 34.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.154 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.552 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.9 mmmt -80.53 -11.12 59.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.596 -176.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.427 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 3.5 tpt -43.12 -43.41 4.47 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.069 0.856 . . . . 0.0 112.005 -172.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.539 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -141.06 10.06 2.14 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.88 179.332 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.745 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 34.2 t70 -82.07 80.7 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.31 0.576 . . . . 0.0 110.854 -176.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.539 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 3.9 m-85 -108.32 -6.11 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.738 178.066 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.5 p30 -75.8 -13.68 60.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.734 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.67 23.66 72.13 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 116.025 -0.534 . . . . 0.0 113.464 175.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -108.41 -8.65 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.616 0.708 . . . . 0.0 110.964 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.444 ' HB3' ' HZ ' ' A' ' 77' ' ' PHE . 81.7 m-20 64.41 20.58 12.21 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.564 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.49 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.9 mm? -127.89 157.04 41.6 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.609 ' HB2' HG22 ' A' ' 136' ' ' ILE . 83.2 mt -113.2 110.82 21.03 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.045 0.45 . . . . 0.0 111.537 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.524 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 8.0 t70 -83.31 161.45 21.42 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.565 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -44.59 -56.14 5.77 Favored Glycine 0 N--CA 1.464 0.514 0 N-CA-C 114.909 0.723 . . . . 0.0 114.909 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -73.55 -30.99 63.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.644 0.722 . . . . 0.0 111.262 -174.16 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.745 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.7 tt0 -69.61 -58.62 3.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.292 1.044 . . . . 0.0 108.768 176.236 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.951 ' HG ' HG12 ' A' ' 97' ' ' ILE . 40.7 tp -61.92 -10.44 9.5 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.755 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.849 ' HA ' HD13 ' A' ' 121' ' ' ILE . 18.8 m -51.94 -32.37 32.76 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.143 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.1 m -85.76 -27.34 25.28 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.531 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.826 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -85.17 -37.89 19.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -172.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.951 HG12 ' HG ' ' A' ' 93' ' ' LEU . 46.1 mm -64.3 -21.76 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 CA-C-O 120.902 0.382 . . . . 0.0 111.037 -177.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.647 HG22 ' HB1' ' A' ' 109' ' ' ALA . 4.2 m -57.58 -31.09 65.81 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.972 174.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.552 ' ND1' ' HB2' ' A' ' 109' ' ' ALA . 98.7 m-70 -101.42 -32.97 10.18 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.555 176.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.828 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 36.7 t -56.89 -52.42 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.486 0.184 . . . . 0.0 110.875 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -69.23 81.18 0.35 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.216 171.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 145' ' ' LEU . 1.3 pptp? -64.54 153.64 38.5 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.862 176.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -144.88 -67.85 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.845 0.355 . . . . 0.0 110.67 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -90.69 -10.18 44.06 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.405 0.621 . . . . 0.0 110.372 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.467 ' HA3' ' OE1' ' A' ' 108' ' ' GLN . . . -175.45 174.12 46.64 Favored Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 178.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 19.8 m -67.65 -66.66 0.53 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.557 0.679 . . . . 0.0 110.771 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.591 ' HA ' ' OH ' ' A' ' 76' ' ' TYR . 31.4 mm-40 -73.26 -17.64 61.31 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.368 0.604 . . . . 0.0 110.938 -179.137 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.467 ' OE1' ' HA3' ' A' ' 105' ' ' GLY . 51.9 mt-30 -71.52 107.57 4.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.483 -176.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.647 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -76.83 122.92 87.3 Favored Pre-proline 0 CA--C 1.502 -0.878 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.339 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -83.04 67.1 7.79 Favored 'Trans proline' 0 N--CA 1.436 -1.862 0 C-N-CA 121.555 1.503 . . . . 0.0 111.305 175.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.22 79.61 0.05 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.368 1.08 . . . . 0.0 109.852 173.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.447 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.0 ptt? -92.15 -58.35 2.42 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 113.631 -1.622 . . . . 0.0 110.436 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.6 m -161.02 120.95 2.68 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.49 ' O ' HG13 ' A' ' 118' ' ' ILE . 9.2 pt-20 -56.39 -27.03 55.11 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -174.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.84 -47.18 78.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.375 0.607 . . . . 0.0 110.12 176.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.19 -38.8 85.97 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -60.65 -38.69 85.69 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.355 178.771 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 114' ' ' GLU . 30.9 mt -59.39 -50.62 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.517 174.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.2 -33.01 74.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.132 0.491 . . . . 0.0 110.357 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.2 mp -63.73 -45.68 96.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.01 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.857 ' HA ' HG21 ' A' ' 97' ' ' ILE . 71.7 mt -62.94 -44.94 99.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 121.141 0.496 . . . . 0.0 109.705 176.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.758 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.7 t70 -57.55 -44.55 85.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.429 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.46 -31.77 60.28 Favored Glycine 0 C--N 1.334 0.453 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.448 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.916 HG21 HD12 ' A' ' 97' ' ' ILE . 44.5 t -63.39 -51.62 68.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.271 173.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.62 -6.82 22.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.275 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.758 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 19.7 mtm180 -101.64 -47.77 4.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.045 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -115.56 -44.88 2.93 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.504 ' HB2' HG13 ' A' ' 124' ' ' VAL . 17.4 m-20 -70.96 -22.06 62.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.025 0.44 . . . . 0.0 111.049 -177.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -80.12 84.34 5.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -71.55 -26.65 62.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.756 -174.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ASN . . . . . 0.476 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.6 m120 -76.45 -14.72 60.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.305 -173.065 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.7 t30 63.41 25.94 14.75 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.663 0.744 . . . . 0.0 109.221 -175.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -92.47 -15.0 27.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.837 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.5 -25.34 28.43 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.9 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.524 ' CD2' ' HA ' ' A' ' 89' ' ' ASP . 14.2 m-85 -116.42 162.79 17.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.176 -176.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.609 HG22 ' HB2' ' A' ' 88' ' ' LEU . 7.3 tt -96.65 130.89 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.465 0.65 . . . . 0.0 110.263 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -103.02 172.03 7.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.53 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.812 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 11.2 t80 -53.25 -48.03 68.57 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 123.135 0.272 . . . . 0.0 110.752 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -64.44 -31.21 72.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.485 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -75.87 -52.43 10.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.573 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.812 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.0 p90 -70.16 -28.05 65.02 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.397 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.57 -40.37 96.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 120.941 0.401 . . . . 0.0 110.447 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.8 mtmt -74.14 -28.81 61.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.762 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 13.7 t -80.94 -33.86 33.72 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.97 -174.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 102' ' ' LYS . 4.0 pp -83.39 -42.05 17.46 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.336 -0.228 . . . . 0.0 111.502 -178.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.809 179.277 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.504 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 91.7 mmm . . . . . 0 N--CA 1.464 0.256 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.495 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -93.9 161.34 30.28 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.543 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 10.1 Cg_endo -52.29 -46.62 31.64 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.145 2.563 . . . . 0.0 113.82 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -61.63 -50.28 73.17 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.252 -172.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.437 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 7.8 pm0 -71.97 -28.94 63.76 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.398 176.42 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.507 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 13.0 mt -66.76 -21.13 66.07 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.3 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.55 ' HG2' HD12 ' A' ' 145' ' ' LEU . 96.3 mt-30 -69.35 -46.46 66.95 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 173.706 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.47 -21.93 66.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.757 172.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.507 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 11.0 t-80 -69.99 -44.29 69.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.175 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.597 ' HE2' ' CD2' ' A' ' 145' ' ' LEU . 5.3 m-30 -67.58 -26.82 66.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.527 0.68 . . . . 0.0 109.371 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.641 ' HA ' HD11 ' A' ' 88' ' ' LEU . 48.6 t80 -74.87 -52.61 10.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 114.526 -1.215 . . . . 0.0 109.989 179.182 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.549 ' HA ' ' HE3' ' A' ' 78' ' ' LYS . 19.7 mmmt -81.15 -24.63 37.44 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -174.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 18.2 tpp -44.84 -46.06 10.53 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -172.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.89 ' CE1' HD22 ' A' ' 88' ' ' LEU . 1.8 p80 -130.26 8.28 5.08 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.578 -169.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.645 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 29.3 t70 -84.49 64.84 8.64 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.961 0.886 . . . . 0.0 109.357 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -95.66 3.29 54.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.627 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -89.27 -14.24 36.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.14 26.63 71.84 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.557 -0.747 . . . . 0.0 113.85 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -109.03 -1.74 18.68 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.714 0.757 . . . . 0.0 112.259 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 67.99 14.31 9.32 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.365 0.416 . . . . 0.0 111.512 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.536 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.8 mm? -126.35 155.25 42.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.89 HD22 ' CE1' ' A' ' 80' ' ' HIS . 17.8 mt -111.69 113.63 26.12 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.201 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.27 176.12 6.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.546 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.03 -51.88 47.03 Favored Glycine 0 CA--C 1.518 0.223 0 N-CA-C 114.238 0.455 . . . . 0.0 114.238 -178.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.611 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.0 pp -73.81 -26.28 60.53 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.359 0.579 . . . . 0.0 110.77 -173.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.645 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 46.9 mt-10 -65.0 -54.8 24.69 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 122.112 0.958 . . . . 0.0 108.509 168.163 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.88 ' HB3' HG12 ' A' ' 97' ' ' ILE . 57.1 mt -60.46 -10.04 4.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.077 -1.419 . . . . 0.0 112.53 -175.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.68 ' HA ' HD13 ' A' ' 121' ' ' ILE . 85.0 p -51.49 -33.08 29.93 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.54 0.525 . . . . 0.0 111.55 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -90.26 -33.33 16.18 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -93.96 -32.21 13.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -168.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.881 HD12 HG21 ' A' ' 124' ' ' VAL . 35.3 mm -65.4 -23.18 32.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.267 0.556 . . . . 0.0 110.445 -177.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.769 HG23 HD21 ' A' ' 117' ' ' LEU . 13.4 m -60.07 -17.84 42.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.9 174.422 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -110.59 -38.3 5.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.032 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.767 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 54.9 t -56.85 -59.53 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.116 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.431 ' CD2' HG13 ' A' ' 120' ' ' ILE . 7.7 t60 -85.47 65.35 9.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.401 0.62 . . . . 0.0 109.423 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 105' ' ' GLY . 20.2 pttp -59.47 161.61 5.65 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.397 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -140.7 -80.53 0.26 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.957 -179.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -75.89 -60.48 2.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.869 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 102' ' ' LYS . . . -83.99 165.44 41.68 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 174.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.452 ' HA ' ' HD2' ' A' ' 102' ' ' LYS . 19.9 m -95.02 -61.23 1.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.937 0.399 . . . . 0.0 110.739 -177.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -108.5 3.86 23.57 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.742 0.782 . . . . 0.0 110.228 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.469 ' CG ' ' HA3' ' A' ' 105' ' ' GLY . 4.4 pt20 -105.54 147.3 28.52 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.712 177.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.44 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -77.07 116.96 61.81 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-O 120.506 0.193 . . . . 0.0 111.002 -176.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 11.8 Cg_endo -91.38 69.37 1.1 Allowed 'Trans proline' 0 N--CA 1.435 -1.921 0 C-N-CA 122.231 1.954 . . . . 0.0 111.678 175.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.8 mt -51.1 93.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.669 0.747 . . . . 0.0 110.967 173.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -100.82 -55.29 2.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.623 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.7 m -160.74 118.28 2.43 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.489 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.7 OUTLIER -55.41 -36.64 66.67 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -174.541 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -67.57 -49.67 62.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.108 0.48 . . . . 0.0 110.154 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.28 -36.93 74.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.202 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.769 HD21 HG23 ' A' ' 98' ' ' THR . 9.8 tp -66.44 -41.09 89.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.323 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.2 mt -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.392 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -70.77 -31.47 68.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.431 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.431 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.0 OUTLIER -62.02 -38.54 81.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.273 175.911 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.874 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -64.08 -41.6 92.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.914 176.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.705 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.1 t70 -62.3 -44.1 97.3 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.613 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.91 -30.24 56.65 Favored Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.492 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.881 HG21 HD12 ' A' ' 97' ' ' ILE . 42.7 t -63.67 -50.49 77.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.996 0.427 . . . . 0.0 110.362 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.27 -6.25 22.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.051 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.705 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 27.8 mtm-85 -98.88 -48.47 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.055 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -121.27 -39.65 2.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.537 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 21.6 m-20 -67.48 -21.89 65.49 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.031 0.443 . . . . 0.0 110.967 -178.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.525 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.7 t70 -76.1 92.64 3.23 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 166.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -78.96 -27.69 43.58 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.471 -168.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.51 4.84 36.34 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.974 -170.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.525 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 65.0 t30 57.35 53.29 7.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.133 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -108.49 -3.86 17.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.773 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.15 -18.9 37.92 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.94 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.536 ' HB2' HD12 ' A' ' 87' ' ' LEU . 48.8 m-85 -117.36 177.34 4.77 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.878 0.37 . . . . 0.0 110.025 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.573 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.3 tt -113.38 123.52 69.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.403 0.62 . . . . 0.0 109.492 174.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -101.62 -179.34 3.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.836 177.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.872 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 9.4 t80 -52.2 -51.19 59.65 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.579 0.549 . . . . 0.0 111.476 -173.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.54 -22.04 64.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -175.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.468 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 52.6 mt-10 -80.08 -50.8 9.83 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -174.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.872 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 5.0 p90 -71.44 -33.59 69.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.84 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.12 77.16 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.848 0.356 . . . . 0.0 110.821 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -73.08 -29.22 62.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.111 176.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.471 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 7.7 t -81.14 -18.9 44.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -174.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.758 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 91.3 mt -85.51 1.43 48.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.989 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 . . . . . 0 C--O 1.243 0.759 0 CA-C-O 118.668 -0.682 . . . . 0.0 110.303 179.327 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.701 ' HB2' ' CD1' ' A' ' 72' ' ' LEU . 85.6 mmm . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.8 m -96.69 153.45 38.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.166 177.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -49.36 -43.1 39.28 Favored 'Trans proline' 0 N--CA 1.479 0.657 0 C-N-CA 122.931 2.421 . . . . 0.0 113.573 -173.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -56.72 -44.87 82.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.055 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 2.0 mm-40 -64.93 -43.8 91.58 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.279 174.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.701 ' CD1' ' HB2' ' A' ' 67' ' ' MET . 7.7 mp -57.2 -24.8 56.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -169.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.61 ' HG2' HD21 ' A' ' 145' ' ' LEU . 66.4 mt-30 -63.9 -50.42 68.81 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 173.473 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 34.2 tp -63.49 -24.07 67.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.011 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.579 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 13.7 t60 -66.62 -38.25 86.54 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 4.3 m-30 -71.92 -37.02 70.13 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.283 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.66 ' HA ' HD11 ' A' ' 88' ' ' LEU . 48.7 t80 -62.16 -52.75 62.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.943 178.476 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -80.24 -13.66 59.05 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.57 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.63 -45.83 9.8 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 124.044 0.84 . . . . 0.0 111.069 -171.246 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.485 ' CD2' ' HE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -139.54 9.97 2.46 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.966 -178.634 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.75 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 26.2 t70 -85.07 82.96 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.892 0.853 . . . . 0.0 109.758 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.485 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.7 OUTLIER -121.63 15.17 11.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.144 -177.254 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -95.12 -13.33 25.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.219 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 12.14 80.59 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.249 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -98.34 -4.15 35.55 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 117.394 0.597 . . . . 0.0 111.065 -178.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 58.38 34.4 23.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.605 176.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.451 HD22 ' HB2' ' A' ' 135' ' ' TYR . 7.9 mt -151.54 149.37 29.12 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.563 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.66 HD11 ' HA ' ' A' ' 77' ' ' PHE . 68.8 mt -94.81 113.21 24.94 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.973 0.416 . . . . 0.0 111.823 -177.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.485 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 8.9 t70 -91.71 167.0 12.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.391 177.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.86 -49.93 39.82 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.66 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -68.92 -29.22 67.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 117.413 0.606 . . . . 0.0 110.631 -176.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.75 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 50.8 mt-10 -69.83 -48.54 58.58 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.826 ' HB3' HG12 ' A' ' 97' ' ' ILE . 25.2 mt -65.26 -11.24 39.3 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.31 -178.427 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.672 ' HA ' HD13 ' A' ' 121' ' ' ILE . 65.9 m -58.46 -33.35 69.65 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.832 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -93.35 -27.67 16.63 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.217 0.532 . . . . 0.0 111.482 174.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . . . -86.51 -41.43 14.36 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -169.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.899 HG21 ' HA ' ' A' ' 121' ' ' ILE . 43.0 mm -64.43 -21.13 28.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.012 0.434 . . . . 0.0 110.692 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.717 HG22 ' HB1' ' A' ' 109' ' ' ALA . 2.6 m -58.12 -21.95 48.83 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.54 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 80.6 m-70 -115.16 -6.2 12.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.322 176.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.736 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 42.0 t -90.13 -46.39 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -66.05 93.99 0.22 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.771 0.32 . . . . 0.0 111.432 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -65.22 137.94 57.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.073 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 179.0 -67.98 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.295 174.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.5 ' HB2' ' HB3' ' A' ' 110' ' ' PRO . 13.0 tp10 -64.94 -29.81 70.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.013 0.911 . . . . 0.0 108.902 173.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.608 ' HA3' ' HG2' ' A' ' 108' ' ' GLN . . . -171.02 -178.09 41.33 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 114.065 -1.425 . . . . 0.0 109.555 174.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.504 ' HB3' ' O ' ' A' ' 145' ' ' LEU . 53.9 m -98.42 -42.53 7.3 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 117.377 0.589 . . . . 0.0 110.336 178.162 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -97.61 -28.21 14.03 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.568 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.608 ' HG2' ' HA3' ' A' ' 105' ' ' GLY . 12.0 pt20 -83.82 149.95 26.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.135 0.493 . . . . 0.0 111.406 -174.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.717 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -85.39 122.5 73.59 Favored Pre-proline 0 CA--C 1.512 -0.513 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.893 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.5 ' HB3' ' HB2' ' A' ' 104' ' ' GLU . 3.4 Cg_exo -80.78 72.56 6.46 Favored 'Trans proline' 0 N--CA 1.444 -1.42 0 C-N-CA 122.083 1.855 . . . . 0.0 111.795 173.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.23 80.44 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.921 0.867 . . . . 0.0 110.383 169.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.424 ' H ' ' HG2' ' A' ' 112' ' ' MET . 15.1 ptt? -98.94 -60.51 1.52 Allowed 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.668 -178.137 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.8 m -165.6 120.19 1.24 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.07 -35.29 66.8 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -172.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.2 -46.79 88.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.217 0.532 . . . . 0.0 110.544 179.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.03 -33.65 63.83 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.115 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.67 HD21 HG23 ' A' ' 98' ' ' THR . 17.0 tp -61.25 -39.01 88.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.998 175.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 51.3 mt -61.38 -44.01 97.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.129 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -68.27 -33.13 73.79 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.395 0.617 . . . . 0.0 110.331 176.042 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.48 -40.53 84.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.416 174.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.899 ' HA ' HG21 ' A' ' 97' ' ' ILE . 90.3 mt -61.79 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.146 177.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.76 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.7 t70 -58.7 -44.43 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.556 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.87 -33.89 50.59 Favored Glycine 0 C--N 1.332 0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.184 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.821 HG21 HD12 ' A' ' 97' ' ' ILE . 39.8 t -63.0 -53.84 41.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.582 0.23 . . . . 0.0 110.872 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.536 HD11 HD12 ' A' ' 93' ' ' LEU . 9.0 mp -63.95 -14.52 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.967 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.76 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.4 mtm180 -95.0 -50.14 5.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.251 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -117.7 -41.3 2.94 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -170.191 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.511 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -68.1 -18.79 64.75 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.523 0.678 . . . . 0.0 109.669 178.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.642 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 3.2 t70 -72.34 90.68 1.29 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.693 165.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -79.51 -16.85 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.276 -170.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -113.4 13.36 18.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -171.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.8 t30 53.8 50.11 17.67 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.27 173.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -110.9 -9.02 14.46 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.553 -0.459 . . . . 0.0 109.997 173.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 79.72 0.78 85.68 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.524 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.451 ' HB2' HD22 ' A' ' 87' ' ' LEU . 87.2 m-85 -126.08 175.35 7.81 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.593 HG22 ' HB2' ' A' ' 88' ' ' LEU . 10.2 tt -118.56 121.11 66.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.421 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -99.92 -176.87 3.37 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.308 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.847 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.2 t80 -53.41 -50.2 65.69 Favored 'General case' 0 C--O 1.225 -0.227 0 O-C-N 123.66 0.6 . . . . 0.0 111.812 -173.622 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.79 -35.14 78.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.768 0.318 . . . . 0.0 110.756 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.642 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 48.9 mt-10 -66.21 -53.79 32.94 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.815 -174.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.847 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -73.08 -32.03 64.74 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.798 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.61 97.73 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.124 0.487 . . . . 0.0 110.117 178.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -70.09 -29.03 65.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.927 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 9.6 t -82.45 -32.78 28.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.608 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.61 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.5 pp -84.04 12.85 5.69 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.205 0.526 . . . . 0.0 111.065 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.423 -0.799 . . . . 0.0 110.535 178.55 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.649 ' HB2' HD21 ' A' ' 72' ' ' LEU . 97.7 mmm . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 110.45 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.48 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 49.1 m -97.79 161.96 23.95 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.324 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.525 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.8 Cg_exo -50.83 -46.48 30.18 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.94 2.426 . . . . 0.0 114.57 -172.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -59.6 -49.23 78.55 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.48 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 1.6 pm0 -78.35 -26.13 46.6 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 122.048 -0.407 . . . . 0.0 111.121 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.649 HD21 ' HB2' ' A' ' 67' ' ' MET . 11.8 mt -64.41 -20.02 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.533 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 29.6 mt-30 -73.35 -43.04 61.51 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 51.5 tp -65.61 -23.82 66.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.715 173.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.515 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 46.3 t60 -64.3 -37.29 86.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 176.078 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.461 ' HD1' HG22 ' A' ' 100' ' ' VAL . 4.2 m-30 -69.26 -35.31 75.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.629 177.666 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.574 ' HD1' ' HE2' ' A' ' 141' ' ' PHE . 62.9 t80 -68.72 -50.33 51.67 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.514 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -80.05 -13.71 59.1 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.361 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -45.06 -41.29 7.49 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.94 0.775 . . . . 0.0 112.937 -172.035 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.586 ' HB3' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -141.49 10.52 2.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.904 -178.052 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.677 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 23.5 t70 -82.83 81.93 8.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.823 0.82 . . . . 0.0 109.681 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.56 15.62 18.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.723 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.0 p30 -99.69 -13.14 19.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.88 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 71.2 29.42 68.63 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.021 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -106.83 -3.58 20.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.477 0.638 . . . . 0.0 111.342 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 60.65 42.42 13.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.586 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.497 HD22 ' HB2' ' A' ' 135' ' ' TYR . 6.0 mt -158.3 153.56 25.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.419 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.582 ' HB2' HG22 ' A' ' 136' ' ' ILE . 96.4 mt -106.15 113.34 26.82 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.912 0.387 . . . . 0.0 111.29 178.207 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.516 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 16.8 t70 -87.33 157.57 19.25 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.744 172.185 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -46.93 -35.74 8.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.671 -177.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.516 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 36.0 mt -65.42 -40.71 93.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.975 0.417 . . . . 0.0 111.656 -178.066 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.677 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 27.9 mt-10 -74.6 -44.22 51.79 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.549 1.166 . . . . 0.0 108.82 172.555 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.931 ' HG ' HG12 ' A' ' 97' ' ' ILE . 10.7 tp -63.77 -12.97 39.81 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 113.286 -1.779 . . . . 0.0 111.917 -169.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.885 ' HA ' HD13 ' A' ' 121' ' ' ILE . 40.9 p -51.82 -48.77 63.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.419 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -78.29 -26.94 47.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.205 0.526 . . . . 0.0 111.397 -176.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.62 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -80.98 -42.5 21.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.657 -173.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.931 HG12 ' HG ' ' A' ' 93' ' ' LEU . 45.1 mm -66.05 -17.41 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.043 0.449 . . . . 0.0 111.151 -177.303 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.632 HG23 HD21 ' A' ' 117' ' ' LEU . 2.0 m -63.69 -15.13 57.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 175.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -115.58 -32.98 5.37 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.449 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.789 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.3 t -59.86 -53.78 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.77 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 32.6 t-80 -73.65 74.53 1.52 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.001 0.429 . . . . 0.0 110.499 178.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.571 ' HB2' ' HA ' ' A' ' 106' ' ' SER . 23.2 pttm -71.65 145.83 48.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.98 176.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.692 ' HG3' ' H ' ' A' ' 104' ' ' GLU . 5.8 pt-20 -151.86 -78.4 0.12 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.842 174.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.692 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 11.5 pt-20 -87.06 14.26 7.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.596 0.713 . . . . 0.0 110.066 176.185 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.42 139.5 3.69 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.571 ' HA ' ' HB2' ' A' ' 102' ' ' LYS . 4.3 m -87.36 -41.35 13.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.484 0.659 . . . . 0.0 110.349 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.436 ' H ' ' CD ' ' A' ' 107' ' ' GLU . 0.4 OUTLIER -95.11 -27.08 15.75 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.021 -177.183 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -76.21 141.6 41.74 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.043 -177.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.578 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -88.58 118.41 69.36 Favored Pre-proline 0 CA--C 1.509 -0.625 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.818 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.419 ' O ' ' HG2' ' A' ' 112' ' ' MET . 7.4 Cg_exo -73.29 60.31 3.97 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.364 2.043 . . . . 0.0 111.68 177.058 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.66 77.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.114 0.959 . . . . 0.0 110.979 174.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 110' ' ' PRO . 8.0 ptt? -95.44 -59.1 1.95 Allowed 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.718 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.418 ' H ' ' HG3' ' A' ' 112' ' ' MET . 40.3 m -160.59 118.58 2.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.499 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.0 pt-20 -52.54 -37.02 56.79 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -172.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -66.3 -42.05 88.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.979 0.418 . . . . 0.0 110.471 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -75.35 -29.06 59.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.315 178.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.632 HD21 HG23 ' A' ' 98' ' ' THR . 13.8 tp -65.0 -38.54 91.3 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 173.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 114' ' ' GLU . 90.6 mt -62.07 -43.1 97.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.249 172.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -63.43 -34.96 78.88 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.084 0.469 . . . . 0.0 110.407 175.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -39.56 85.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.38 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.885 HD13 ' HA ' ' A' ' 94' ' ' SER . 78.5 mt -66.27 -41.78 89.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.429 0.633 . . . . 0.0 109.865 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.795 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 29.6 t70 -62.33 -44.25 96.92 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.666 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLY . . . . . 0.489 ' HA2' ' HD3' ' A' ' 126' ' ' ARG . . . -54.3 -34.37 53.86 Favored Glycine 0 C--N 1.334 0.46 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.998 176.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.923 HG21 HD12 ' A' ' 97' ' ' ILE . 39.0 t -59.07 -53.41 48.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.886 0.375 . . . . 0.0 110.196 172.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 62.7 mt -68.46 -0.77 5.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.618 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.795 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.9 mtp180 -103.43 -47.98 4.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.681 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -121.38 -38.23 2.81 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -173.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.538 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -75.77 -16.49 60.12 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.192 0.52 . . . . 0.0 110.805 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.604 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.5 t70 -78.9 87.24 4.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 169.249 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -74.88 -32.79 61.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.139 -168.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.98 -3.09 58.95 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.609 -176.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.604 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 18.7 m120 60.71 43.24 12.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.018 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.1 p30 -98.17 -12.58 21.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.358 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.68 4.29 89.05 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.335 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.497 ' HB2' HD22 ' A' ' 87' ' ' LEU . 59.2 m-85 -129.56 -179.85 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 175.219 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.582 HG22 ' HB2' ' A' ' 88' ' ' LEU . 8.9 tt -120.81 120.74 63.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.43 0.633 . . . . 0.0 110.142 174.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -97.22 -178.09 4.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.823 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 21.5 t80 -55.21 -49.04 72.97 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.413 0.446 . . . . 0.0 111.669 -172.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.64 -31.49 71.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.489 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.55 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.7 mt-10 -68.69 -51.26 43.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.404 -176.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.823 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.8 p90 -74.98 -32.48 61.69 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.734 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -61.08 -45.45 94.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.956 0.408 . . . . 0.0 110.074 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -65.62 -30.15 70.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.22 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 8.0 t -82.67 -37.01 25.43 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.831 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.424 ' O ' ' HD3' ' A' ' 102' ' ' LYS . 3.8 pp -82.52 -27.04 31.96 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.206 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 . . . . . 0 C--O 1.246 0.873 0 CA-C-O 118.354 -0.832 . . . . 0.0 110.461 179.687 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.618 ' HE1' ' HA ' ' A' ' 72' ' ' LEU . 51.8 mtp . . . . . 0 CA--C 1.52 -0.177 0 CA-C-O 121.057 0.455 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 3.9 m -91.44 152.91 44.11 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.738 177.005 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.58 -49.05 18.8 Favored 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.237 1.958 . . . . 0.0 113.698 -176.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -60.42 -41.02 93.1 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.451 -175.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 68' ' ' SER . 12.9 pt-20 -75.74 -33.94 60.28 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.751 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.635 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -64.95 -21.68 66.87 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.329 0.585 . . . . 0.0 111.309 -174.532 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.49 ' HG2' HD21 ' A' ' 145' ' ' LEU . 45.7 mt-30 -73.09 -43.47 61.76 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 175.256 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.59 -20.86 66.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.911 172.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.635 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 13.0 t-80 -64.65 -44.1 91.51 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 120.856 0.36 . . . . 0.0 110.348 175.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.74 ' CD1' HG22 ' A' ' 100' ' ' VAL . 3.8 m-30 -66.34 -25.97 67.07 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.24 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.759 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.6 t80 -74.17 -53.75 9.2 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.297 177.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.759 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.4 mmmt -80.63 -12.72 59.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.331 -173.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.466 ' HG2' ' HA ' ' A' ' 96' ' ' ALA . 1.0 OUTLIER -45.51 -35.69 4.03 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.981 0.801 . . . . 0.0 112.244 -174.149 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.79 10.58 1.06 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.575 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 30.1 t70 -84.55 81.71 8.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.909 0.861 . . . . 0.0 110.337 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -99.31 -6.88 27.16 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.286 177.386 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -95.8 -14.52 23.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.614 -174.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 66.37 23.96 72.01 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 114.911 0.724 . . . . 0.0 114.911 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -84.47 3.54 35.84 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.299 1.049 . . . . 0.0 111.026 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.621 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 29.2 m-80 59.52 28.0 17.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.531 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.0 mt -148.99 167.45 25.77 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.958 177.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.534 ' HB2' HG22 ' A' ' 136' ' ' ILE . 13.0 mt -135.26 122.08 21.04 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.201 -179.312 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -103.67 -170.52 1.79 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -51.21 -38.67 40.85 Favored Glycine 0 CA--C 1.521 0.468 0 O-C-N 123.399 0.437 . . . . 0.0 113.978 -174.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.2 mt -67.75 -41.25 83.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.354 0.597 . . . . 0.0 111.09 -175.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.575 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 40.1 mt-10 -74.69 -45.79 42.05 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.624 0.726 . . . . 0.0 109.886 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.572 ' HB3' HG12 ' A' ' 97' ' ' ILE . 21.7 mt -63.92 -20.36 65.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.98 -1.009 . . . . 0.0 113.148 -172.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.769 ' HA ' HD13 ' A' ' 121' ' ' ILE . 53.4 p -53.53 -36.7 62.08 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.735 0.302 . . . . 0.0 111.624 -177.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -90.04 -33.4 16.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 0.0 111.141 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.598 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.16 -47.47 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.738 -171.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.879 HD12 HG21 ' A' ' 124' ' ' VAL . 36.5 mm -59.44 -22.75 23.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.612 -174.221 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.835 HG23 HD21 ' A' ' 117' ' ' LEU . 18.5 m -58.88 -18.24 31.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.308 175.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.472 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 85.4 m-70 -113.96 -17.27 12.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.403 176.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.74 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.4 t -88.27 -51.6 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.138 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.504 ' CD2' HG13 ' A' ' 120' ' ' ILE . 52.7 t60 -71.08 106.96 3.91 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.861 -177.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.46 ' HE2' ' O ' ' A' ' 144' ' ' SER . 67.6 mttm -60.6 141.21 56.94 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.094 179.12 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -162.64 -76.03 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.922 ' HB3' ' HB3' ' A' ' 110' ' ' PRO . 43.7 tt0 -99.89 -34.39 10.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.34 0.59 . . . . 0.0 109.623 173.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.505 ' H ' ' HG3' ' A' ' 110' ' ' PRO . . . -122.28 135.83 10.5 Favored Glycine 0 N--CA 1.441 -0.981 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.585 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.8 m -76.95 -44.92 29.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.073 0.463 . . . . 0.0 110.33 177.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -111.38 -32.13 6.82 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.977 178.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.404 ' O ' ' HD3' ' A' ' 110' ' ' PRO . 48.1 mt-30 -80.1 155.85 27.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.243 -176.524 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.472 ' HB2' ' CE1' ' A' ' 99' ' ' HIS . . . -80.85 111.52 24.14 Favored Pre-proline 0 CA--C 1.509 -0.624 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.496 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.922 ' HB3' ' HB3' ' A' ' 104' ' ' GLU . 2.8 Cg_endo -83.11 64.36 7.86 Favored 'Trans proline' 0 N--CA 1.439 -1.72 0 C-N-CA 122.03 1.82 . . . . 0.0 110.874 176.564 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 46.8 tp -63.08 81.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 122.002 0.906 . . . . 0.0 111.054 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.417 ' H ' ' HG2' ' A' ' 112' ' ' MET . 8.9 ptt? -89.62 -56.09 3.39 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.366 178.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.6 m -159.8 123.57 3.7 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 177.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.577 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.51 -40.86 65.74 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.742 -172.505 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 34.1 t70 -71.12 -39.88 71.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -67.48 -37.15 82.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.355 0.598 . . . . 0.0 109.597 174.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.835 HD21 HG23 ' A' ' 98' ' ' THR . 11.9 tp -61.86 -32.87 73.26 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.048 177.072 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.577 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.7 mt -62.78 -43.96 99.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.416 174.109 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASN . . . . . 0.508 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 16.6 m120 -69.02 -24.17 64.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.183 0.516 . . . . 0.0 110.607 176.16 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.504 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -66.07 -39.0 83.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.575 0.702 . . . . 0.0 109.505 173.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.789 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -68.5 -38.76 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.379 174.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.611 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 94.4 m-20 -53.41 -49.55 67.04 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.732 172.041 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.81 -34.23 36.76 Favored Glycine 0 CA--C 1.508 -0.354 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.981 178.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.879 HG21 HD12 ' A' ' 97' ' ' ILE . 76.7 t -68.0 -51.78 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-O 120.801 0.334 . . . . 0.0 110.939 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.426 HD21 HD12 ' A' ' 93' ' ' LEU . 54.6 mt -67.72 -11.47 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.948 -177.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.611 ' NH1' ' HB3' ' A' ' 122' ' ' ASP . 48.8 mtt180 -105.64 -32.18 8.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.5 -177.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -132.18 -44.62 0.94 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -171.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.572 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 39.7 m-20 -71.62 -19.72 62.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.693 0.282 . . . . 0.0 111.468 -176.257 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.534 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -77.06 99.72 5.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 167.422 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -80.87 -19.08 45.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.904 -170.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 -3.65 29.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.549 -171.021 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 66.68 33.06 6.59 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.427 0.454 . . . . 0.0 111.376 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -97.08 -8.77 29.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.108 0.48 . . . . 0.0 110.056 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLY . . . . . 0.413 ' C ' ' HD2' ' A' ' 135' ' ' TYR . . . 79.97 -8.56 50.3 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.946 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.413 ' HD2' ' C ' ' A' ' 134' ' ' GLY . 5.3 m-30 -115.58 167.09 11.21 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.563 HG22 HD21 ' A' ' 93' ' ' LEU . 8.1 tt -111.76 118.2 57.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.792 0.806 . . . . 0.0 110.436 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -88.13 168.84 12.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.067 177.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.819 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.0 t80 -50.43 -47.67 56.57 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 123.084 0.24 . . . . 0.0 110.406 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.16 75.15 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 120.757 0.313 . . . . 0.0 111.379 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.534 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 45.3 mt-10 -68.68 -54.86 13.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.444 -176.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.819 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -70.72 -30.54 67.1 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.49 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.667 ' O ' ' HG2' ' A' ' 146' ' ' GLN . . . -61.69 -50.23 73.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 176.684 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -63.82 -32.39 73.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.099 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.46 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 15.9 t -77.7 -28.59 51.05 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.385 -177.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.49 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp -89.59 -5.24 57.36 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.412 -0.18 . . . . 0.0 111.107 -179.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.667 ' HG2' ' O ' ' A' ' 142' ' ' ALA . 28.6 mm-40 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.694 -0.669 . . . . 0.0 110.324 177.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.67 ' HB2' HD21 ' A' ' 72' ' ' LEU . 89.6 mmm . . . . . 0 N--CA 1.461 0.115 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.503 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -88.43 153.09 50.59 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.297 0.094 . . . . 0.0 111.196 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.89 -44.02 43.94 Favored 'Trans proline' 0 N--CA 1.476 0.492 0 C-N-CA 123.307 2.671 . . . . 0.0 114.701 -170.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -59.48 -49.06 79.23 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.741 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -74.5 -26.27 59.9 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.586 175.937 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.67 HD21 ' HB2' ' A' ' 67' ' ' MET . 17.2 mt -63.34 -18.89 64.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.405 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 88.8 mt-30 -71.71 -45.43 61.85 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.43 -21.02 66.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.566 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.581 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 7.2 t-80 -66.9 -40.31 87.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.106 177.288 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.615 ' HE2' HD21 ' A' ' 145' ' ' LEU . 5.9 m-30 -68.39 -32.99 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.545 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 57.3 t80 -71.02 -51.17 26.94 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.296 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -80.56 -16.91 53.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.868 -175.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.0 tpp -44.35 -48.69 9.72 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.646 0.591 . . . . 0.0 112.404 -172.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.575 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -130.68 10.22 5.11 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.88 -175.584 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.726 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 26.5 t70 -80.47 75.15 7.33 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.68 0.752 . . . . 0.0 110.005 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -91.53 -15.27 28.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.122 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.6 p30 -76.41 -14.24 60.08 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 -177.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.82 30.57 77.49 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.483 -0.78 . . . . 0.0 113.065 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -101.36 3.45 40.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 117.294 0.547 . . . . 0.0 111.229 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 64.15 34.51 10.98 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.335 0.588 . . . . 0.0 110.479 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.509 ' HB3' ' CD2' ' A' ' 135' ' ' TYR . 15.6 mt -157.23 158.33 35.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.88 178.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.526 HD11 ' HA ' ' A' ' 77' ' ' PHE . 88.3 mt -120.15 121.43 38.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.82 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.464 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 0.6 OUTLIER -92.24 -177.45 4.66 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.399 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -55.85 -37.09 68.36 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.295 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.464 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 26.0 mt -68.66 -47.75 65.73 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.141 0.496 . . . . 0.0 110.368 -177.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.726 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 45.2 mt-10 -64.11 -42.23 96.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.87 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.634 HD21 HG22 ' A' ' 136' ' ' ILE . 24.1 mt -66.55 -18.39 65.34 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.792 -175.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.639 ' HA ' HD13 ' A' ' 121' ' ' ILE . 46.4 t -57.1 -32.06 65.91 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.689 0.28 . . . . 0.0 111.048 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.88 -31.01 15.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.069 0.461 . . . . 0.0 111.188 178.149 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.57 -43.73 12.46 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.867 HD12 HG21 ' A' ' 124' ' ' VAL . 39.7 mm -64.77 -25.91 38.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -175.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.618 HG22 ' HB1' ' A' ' 109' ' ' ALA . 17.9 m -58.47 -20.27 43.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.724 174.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 68.3 m-70 -109.44 -27.07 9.66 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 173.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.768 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 38.4 t -67.48 -58.66 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.719 0.295 . . . . 0.0 111.173 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -82.21 70.52 9.16 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.364 0.602 . . . . 0.0 110.026 -177.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.639 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -66.48 135.23 53.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.569 179.458 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.518 ' H ' ' HG3' ' A' ' 110' ' ' PRO . 20.9 mm-40 -113.91 -49.79 2.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.322 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -91.74 -20.97 20.98 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -175.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -148.2 -142.2 3.61 Favored Glycine 0 CA--C 1.507 -0.461 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.567 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.2 t -123.05 -53.98 1.83 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 117.106 0.453 . . . . 0.0 110.437 178.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.11 -38.76 16.18 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-O 121.346 0.594 . . . . 0.0 110.113 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.433 HE21 ' HB3' ' A' ' 108' ' ' GLN . 2.7 pt20 -64.54 130.03 42.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.518 -173.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.618 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -73.88 121.44 85.19 Favored Pre-proline 0 CA--C 1.505 -0.762 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.703 174.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.518 ' HG3' ' H ' ' A' ' 103' ' ' GLU . 3.7 Cg_exo -78.19 65.99 8.37 Favored 'Trans proline' 0 N--CA 1.443 -1.486 0 C-N-CA 121.745 1.63 . . . . 0.0 111.228 177.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.62 81.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.864 0.84 . . . . 0.0 111.095 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.409 ' CG ' ' H ' ' A' ' 113' ' ' SER . 14.4 ptt? -98.23 -57.81 2.12 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.005 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.409 ' H ' ' CG ' ' A' ' 112' ' ' MET . 73.6 m -162.39 124.58 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.516 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.25 -37.88 65.18 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.132 -173.939 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.78 -43.93 82.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.026 0.441 . . . . 0.0 110.662 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.08 -39.73 86.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.344 0.592 . . . . 0.0 109.932 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.574 HD13 HG23 ' A' ' 98' ' ' THR . 10.8 mt -62.66 -37.67 87.33 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.99 175.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 114' ' ' GLU . 63.6 mt -60.82 -42.98 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.032 0.444 . . . . 0.0 110.619 172.455 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -67.36 -29.81 69.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.222 0.534 . . . . 0.0 110.479 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.44 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.0 OUTLIER -65.57 -34.49 70.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.885 174.656 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.852 ' HA ' HG21 ' A' ' 97' ' ' ILE . 88.4 mt -67.26 -38.34 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.8 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.805 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.9 t70 -60.79 -46.0 92.21 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.232 176.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.56 -37.75 41.91 Favored Glycine 0 C--N 1.334 0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.007 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 54.8 t -63.58 -51.04 75.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 110.417 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.8 mt -65.02 -7.48 12.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.45 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.805 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 13.6 mtm180 -106.42 -49.33 3.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.847 0.356 . . . . 0.0 110.791 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -113.13 -44.19 3.29 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -169.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.51 ' HB2' HG13 ' A' ' 124' ' ' VAL . 27.3 m-20 -71.8 -23.89 61.64 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.151 0.5 . . . . 0.0 110.028 -177.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.607 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 4.6 t70 -76.05 88.22 2.98 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 168.006 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.5 -21.51 57.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.477 -169.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -108.14 6.46 26.85 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.168 -170.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.459 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 44.1 m-80 58.41 38.96 25.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 175.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.9 p30 -96.74 -13.27 22.8 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.308 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.18 2.69 90.45 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.312 178.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.509 ' CD2' ' HB3' ' A' ' 87' ' ' LEU . 28.5 m-85 -124.7 173.43 8.55 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.634 HG22 HD21 ' A' ' 93' ' ' LEU . 6.7 tt -116.18 123.41 71.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.424 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.5 p30 -101.03 -179.69 4.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.384 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.837 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 4.3 t80 -53.65 -50.31 66.05 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 123.558 0.537 . . . . 0.0 111.209 -174.424 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.63 -20.43 64.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.68 -176.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.607 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -80.12 -52.92 7.19 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 -176.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.837 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -70.14 -33.31 71.63 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.274 178.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.37 -41.23 93.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.845 0.355 . . . . 0.0 110.732 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.447 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 31.7 mtmm -70.69 -28.44 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.931 176.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.443 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 14.9 t -80.87 -17.33 51.03 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -175.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.767 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 85.8 mt -89.45 0.54 56.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.419 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.063 178.685 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.681 ' HB2' HD21 ' A' ' 72' ' ' LEU . 94.0 mmm . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.17 158.38 39.33 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-O 119.635 -0.221 . . . . 0.0 110.48 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.601 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 9.6 Cg_endo -52.34 -43.34 54.64 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.904 2.403 . . . . 0.0 113.618 -173.708 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -54.03 51.38 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.933 -175.129 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.8 pm0 -72.36 -28.76 63.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.679 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.786 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 25.7 mt -63.87 -19.7 65.27 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.965 0.412 . . . . 0.0 110.938 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.782 ' HG2' HD21 ' A' ' 145' ' ' LEU . 17.8 mt-30 -66.15 -39.32 89.72 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 174.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.529 ' HG ' ' HG2' ' A' ' 78' ' ' LYS . 30.8 tp -77.22 -19.17 57.03 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.835 173.291 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.786 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 5.5 t-80 -73.32 -38.67 65.74 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.486 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.68 ' CD2' HG22 ' A' ' 100' ' ' VAL . 6.9 m-30 -68.14 -41.61 81.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.035 175.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.664 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 50.0 t80 -66.37 -52.64 44.7 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.522 -175.551 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.664 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.6 mmmt -77.71 -15.77 58.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.989 -175.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.415 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 35.4 tpp -45.39 -44.87 12.28 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 123.84 0.712 . . . . 0.0 111.883 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.542 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -132.48 7.68 4.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.404 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.512 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 24.0 t70 -92.75 85.35 5.19 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.832 0.825 . . . . 0.0 109.487 178.03 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.542 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 23.0 m-85 -96.64 -8.89 30.48 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.209 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -88.63 -16.37 32.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.732 -175.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.72 28.17 65.13 Favored Glycine 0 CA--C 1.524 0.637 0 CA-C-N 115.886 -0.597 . . . . 0.0 113.764 176.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.45 ' O ' ' HB3' ' A' ' 86' ' ' ASN . 18.9 p-10 -95.44 18.1 13.31 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 117.412 0.606 . . . . 0.0 111.5 -174.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 85' ' ' ASN . 4.3 t-20 76.48 -27.09 0.18 Allowed 'General case' 0 N--CA 1.47 0.557 0 O-C-N 123.782 0.676 . . . . 0.0 112.046 175.031 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.6 mm? -112.81 162.63 15.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.105 0.955 . . . . 0.0 112.459 -176.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.507 HD21 ' HB2' ' A' ' 81' ' ' ASP . 1.3 mt -132.26 123.38 26.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.612 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.433 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.0 p-10 -96.25 175.44 6.44 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.41 -37.32 12.14 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 114.108 0.403 . . . . 0.0 114.108 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.433 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 54.6 mt -65.13 -52.52 54.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.468 0.634 . . . . 0.0 110.707 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.512 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 43.9 mt-10 -61.47 -54.67 40.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.307 1.051 . . . . 0.0 109.33 174.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.995 ' HG ' HG12 ' A' ' 97' ' ' ILE . 5.5 tp -66.45 -9.82 37.99 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.836 -1.529 . . . . 0.0 112.917 -166.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' SER . . . . . 1.065 ' HA ' HD13 ' A' ' 121' ' ' ILE . 58.8 p -56.13 -45.32 79.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 111.343 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -23.53 51.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.218 0.532 . . . . 0.0 111.188 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.588 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -86.42 -58.38 2.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.37 -175.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.995 HG12 ' HG ' ' A' ' 93' ' ' LEU . 24.4 mm -61.85 -20.36 23.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.281 -172.031 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.788 HG23 HD21 ' A' ' 117' ' ' LEU . 99.3 m -53.33 -31.52 44.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.081 0.467 . . . . 0.0 110.832 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 57.3 m-70 -94.82 -37.16 11.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.112 0.482 . . . . 0.0 110.823 176.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.939 HG21 ' HE1' ' A' ' 141' ' ' PHE . 2.1 t -72.57 -50.93 31.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.033 -170.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.582 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.7 t60 -78.6 69.76 4.84 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.374 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 106' ' ' SER . 35.4 pttt -64.7 86.29 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.012 -0.995 . . . . 0.0 111.893 -177.429 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.489 ' HG3' ' HG3' ' A' ' 104' ' ' GLU . 13.1 tp10 -67.36 -61.0 2.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.242 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.489 ' HG3' ' HG3' ' A' ' 103' ' ' GLU . 41.1 mt-10 -124.74 56.29 1.31 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.083 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -171.35 -166.16 29.72 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.448 ' O ' ' HD3' ' A' ' 102' ' ' LYS . 9.7 t -126.68 -91.78 0.51 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.885 0.343 . . . . 0.0 110.252 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -93.26 -27.95 16.53 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 121.858 0.837 . . . . 0.0 109.554 -178.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.18 163.46 17.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.565 -178.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.57 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -78.08 117.94 69.12 Favored Pre-proline 0 CA--C 1.506 -0.737 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.012 -174.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.57 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.1 Cg_endo -77.78 67.37 7.97 Favored 'Trans proline' 0 N--CA 1.445 -1.373 0 C-N-CA 121.422 1.415 . . . . 0.0 111.492 174.242 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.55 80.69 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.886 0.85 . . . . 0.0 111.33 173.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.437 ' H ' ' HG2' ' A' ' 112' ' ' MET . 12.2 ptt? -86.59 -56.81 3.25 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.244 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.0 m -163.7 126.36 2.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.423 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -51.15 -38.91 54.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.554 -174.052 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.3 -50.44 65.68 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.048 0.451 . . . . 0.0 111.068 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -64.61 -35.05 79.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.524 0.678 . . . . 0.0 109.946 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.788 HD21 HG23 ' A' ' 98' ' ' THR . 15.7 tp -65.09 -41.62 94.82 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.368 178.086 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 114' ' ' GLU . 55.0 mt -61.56 -42.1 92.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.581 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASN . . . . . 0.429 ' O ' ' HB3' ' A' ' 122' ' ' ASP . 91.8 m-20 -71.62 -23.92 61.79 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.218 0.533 . . . . 0.0 110.71 176.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.582 HG13 ' CD2' ' A' ' 101' ' ' HIS . 0.9 OUTLIER -68.31 -33.66 61.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.303 0.573 . . . . 0.0 109.935 174.065 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 1.065 HD13 ' HA ' ' A' ' 94' ' ' SER . 58.8 mt -75.16 -17.69 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 121.636 0.731 . . . . 0.0 109.861 174.294 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 19.9 t70 -75.44 -36.76 60.69 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.37 -37.27 80.65 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.671 -1.15 . . . . 0.0 113.148 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.669 HG12 ' O ' ' A' ' 121' ' ' ILE . 7.2 p -60.46 -43.34 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 CA-C-N 117.555 0.677 . . . . 0.0 109.97 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.24 -13.82 62.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.082 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.68 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 28.6 mtm-85 -99.22 -50.1 4.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.563 -178.338 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -119.07 -20.98 7.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -168.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.569 ' HB2' HG23 ' A' ' 124' ' ' VAL . 41.5 m-20 -89.89 -27.89 19.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.423 178.491 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.503 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -77.68 94.41 4.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.639 0.733 . . . . 0.0 109.316 172.484 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -80.42 -32.38 37.4 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.217 -0.902 . . . . 0.0 111.462 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.1 -0.18 56.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.676 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.503 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 73.5 m-20 63.88 28.08 14.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.7 176.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.8 p30 -84.06 -13.58 52.73 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.993 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 86.26 1.36 86.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.561 176.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.574 ' HB2' HD12 ' A' ' 87' ' ' LEU . 33.4 m-85 -130.54 176.41 8.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.458 HD12 ' CG2' ' A' ' 124' ' ' VAL . 6.3 tt -111.01 123.57 67.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.269 174.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.97 167.79 11.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.963 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.403 ' HE1' ' HA ' ' A' ' 74' ' ' LEU . 11.2 t80 -51.9 -41.2 61.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.605 0.184 . . . . 0.0 111.397 -178.108 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.78 -44.58 92.96 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.733 0.301 . . . . 0.0 110.693 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.464 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 46.5 mt-10 -67.13 -41.47 86.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.939 ' HE1' HG21 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -59.99 -54.77 42.12 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.496 178.013 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.633 ' O ' ' HG2' ' A' ' 146' ' ' GLN . . . -57.34 -47.04 82.61 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.875 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -65.38 -34.52 78.5 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.854 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.8 t -75.36 -29.75 59.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.939 0.4 . . . . 0.0 110.65 -177.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.782 HD21 ' HG2' ' A' ' 73' ' ' GLN . 3.9 pp -86.77 -3.4 59.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.339 -178.376 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.633 ' HG2' ' O ' ' A' ' 142' ' ' ALA . 29.8 mm-40 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.394 177.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.605 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 97.3 mmm . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 120.949 0.404 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.5 m -81.59 155.1 71.32 Favored Pre-proline 0 C--O 1.223 -0.329 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.656 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.454 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.4 Cg_exo -53.97 -51.39 10.81 Favored 'Trans proline' 0 N--CA 1.477 0.52 0 C-N-CA 122.659 2.239 . . . . 0.0 114.609 -173.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -67.2 -35.85 80.48 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.34 0.59 . . . . 0.0 110.358 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.486 ' HG2' ' CE ' ' A' ' 67' ' ' MET . 5.5 tp10 -58.04 -53.3 59.85 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.928 173.186 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.662 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 24.3 mt -58.07 -23.26 53.93 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 113.808 -1.542 . . . . 0.0 112.933 -175.679 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 13.7 mt-30 -70.93 -41.74 70.79 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 175.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.56 -25.53 66.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.141 171.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.662 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 11.3 t60 -64.38 -40.68 96.29 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.08 174.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' OH ' ' HB3' ' A' ' 99' ' ' HIS . 3.6 m-30 -67.93 -30.72 70.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.235 0.54 . . . . 0.0 109.995 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.688 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.4 t80 -69.43 -51.83 32.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.762 177.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.688 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.4 mmmt -79.36 -12.51 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.412 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.4 tpt -44.88 -36.83 3.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.989 0.915 . . . . 0.0 112.688 -172.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.518 ' HA ' ' CE2' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -147.57 10.23 0.95 Allowed 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.867 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.732 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 28.6 t70 -86.38 88.22 7.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.319 0.58 . . . . 0.0 110.396 -178.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.518 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 29.0 m-85 -112.02 -0.92 15.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.944 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -85.12 -13.82 49.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.043 -171.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.69 13.95 81.71 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.167 -0.54 . . . . 0.0 113.363 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -92.97 -5.29 51.02 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.712 0.756 . . . . 0.0 110.781 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 62.47 20.01 11.6 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.596 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.51 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.3 mm? -132.32 153.18 50.98 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.212 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.719 ' HB2' HG22 ' A' ' 136' ' ' ILE . 3.9 mm? -106.59 114.53 28.69 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.173 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.498 ' OD2' ' HG3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -93.77 -178.91 4.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.3 178.819 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.09 -51.04 48.91 Favored Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 114.309 0.484 . . . . 0.0 114.309 -176.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.609 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.4 pp -73.8 -28.45 61.65 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.115 0.457 . . . . 0.0 110.875 -174.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.732 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 50.4 mt-10 -66.68 -52.15 48.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.037 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.861 ' HB3' HG12 ' A' ' 97' ' ' ILE . 30.3 mt -66.71 -7.38 20.53 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.393 -177.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.729 ' HA ' HD13 ' A' ' 121' ' ' ILE . 75.4 m -56.84 -31.77 65.09 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.109 176.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -91.61 -32.17 15.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.074 0.464 . . . . 0.0 111.15 175.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -84.29 -41.7 16.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.226 -169.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.885 ' HB ' HG12 ' A' ' 121' ' ' ILE . 40.2 mm -68.05 -17.85 22.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -177.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.835 HG23 HD13 ' A' ' 117' ' ' LEU . 4.7 m -60.01 -25.91 65.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.166 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.5 ' HB3' ' OH ' ' A' ' 76' ' ' TYR . 62.2 m-70 -103.5 -33.56 9.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.663 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.829 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 32.6 t -58.59 -51.41 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 177.743 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -70.61 85.62 0.64 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 167.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -81.11 161.2 24.22 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 174.93 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -151.57 -84.9 0.08 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.963 -177.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -75.65 -25.9 57.24 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.446 0.641 . . . . 0.0 110.012 178.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLY . . . . . 0.654 ' HA3' ' HG2' ' A' ' 108' ' ' GLN . . . -129.94 172.35 20.14 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 172.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.436 ' HA ' ' HB2' ' A' ' 102' ' ' LYS . 11.2 m -100.37 -46.89 5.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 117.694 0.747 . . . . 0.0 110.341 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.48 ' H ' ' CD ' ' A' ' 107' ' ' GLU . 0.8 OUTLIER -88.15 -31.54 19.1 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.443 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.654 ' HG2' ' HA3' ' A' ' 105' ' ' GLY . 20.0 pt20 -77.82 138.11 38.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.11 0.481 . . . . 0.0 110.775 -178.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.572 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -77.3 124.17 87.01 Favored Pre-proline 0 CA--C 1.507 -0.689 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.198 176.492 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 98' ' ' THR . 53.4 Cg_endo -79.65 65.67 8.86 Favored 'Trans proline' 0 N--CA 1.441 -1.56 0 C-N-CA 121.552 1.501 . . . . 0.0 111.323 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -49.84 94.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.505 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -106.94 -47.78 3.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.064 -179.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.4 m 179.99 117.96 0.05 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -177.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.538 ' O ' HG13 ' A' ' 118' ' ' ILE . 16.3 pt-20 -56.76 -36.69 70.1 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.794 -175.112 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -66.78 -45.63 77.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.833 0.349 . . . . 0.0 110.182 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.09 -44.32 96.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.644 0.735 . . . . 0.0 109.888 177.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.835 HD13 HG23 ' A' ' 98' ' ' THR . 11.7 mt -60.23 -37.7 81.13 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.699 -1.137 . . . . 0.0 111.521 176.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.705 ' HA ' HD12 ' A' ' 121' ' ' ILE . 61.8 mt -61.07 -37.34 77.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.839 0.352 . . . . 0.0 110.91 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -65.38 -38.14 89.14 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.477 0.656 . . . . 0.0 109.266 174.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.417 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -61.57 -42.16 92.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.765 174.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.885 HG12 ' HB ' ' A' ' 97' ' ' ILE . 93.3 mt -60.52 -36.93 73.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.603 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.829 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 33.9 t70 -61.31 -43.64 98.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.241 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.59 -29.04 60.52 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.718 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.799 HG21 HD12 ' A' ' 97' ' ' ILE . 79.1 t -65.01 -53.81 36.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.494 0.187 . . . . 0.0 110.759 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 67.4 mt -65.65 -14.11 60.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.37 -175.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.829 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 15.9 mtp85 -103.66 -36.0 8.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.105 -177.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -124.08 -47.08 1.92 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -170.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.583 ' HB3' HG13 ' A' ' 124' ' ' VAL . 12.6 t70 -71.91 -19.29 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.77 0.795 . . . . 0.0 109.809 -178.341 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.536 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 1.6 t70 -72.56 90.85 1.37 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.689 166.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -79.19 -27.9 42.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.214 -170.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -88.26 -3.66 58.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.76 -176.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.536 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 14.1 t30 61.65 49.48 4.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.586 0.708 . . . . 0.0 110.727 179.388 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 52.8 p30 -107.62 -8.29 16.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.516 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.37 1.31 90.41 Favored Glycine 0 C--N 1.329 0.183 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.055 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.51 ' HB2' HD12 ' A' ' 87' ' ' LEU . 50.4 m-85 -131.21 178.02 7.02 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 174.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.719 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.1 tt -114.97 126.21 72.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.217 0.532 . . . . 0.0 109.607 175.244 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -102.78 -178.22 3.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.704 175.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.835 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 44.1 t80 -56.75 -46.91 81.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 123.341 0.4 . . . . 0.0 111.598 -172.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.2 -28.27 67.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.646 0.26 . . . . 0.0 111.344 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.496 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.5 mt-10 -72.74 -56.37 5.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.231 -175.11 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.835 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.9 p90 -70.6 -27.72 64.3 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.159 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.52 -34.24 77.76 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.337 179.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.418 ' HB2' ' HE3' ' A' ' 143' ' ' LYS . 47.4 mtmt -76.7 -32.61 57.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.374 177.244 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.551 ' OG ' ' HA ' ' A' ' 141' ' ' PHE . 1.3 p -82.27 -30.36 30.68 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.572 -174.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.5 pp -78.37 0.79 24.23 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.512 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.198 175.15 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.565 ' HB2' HD21 ' A' ' 72' ' ' LEU . 92.3 mmm . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.49 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 6.3 m -76.4 160.7 77.0 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -178.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.49 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 9.9 Cg_endo -52.79 -43.69 53.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.928 2.418 . . . . 0.0 112.693 -178.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 6.9 pt20 -56.98 -48.37 78.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.531 178.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.414 ' H ' ' HG3' ' A' ' 70' ' ' GLN . 3.8 mm-40 -59.61 -52.97 63.26 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.502 175.207 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.588 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 24.3 mt -60.38 -21.68 62.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.184 -166.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLN . . . . . 0.565 ' HG2' HD21 ' A' ' 145' ' ' LEU . 76.8 mt-30 -70.34 -46.2 64.62 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 174.222 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.9 tp -66.15 -22.36 66.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.831 172.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.588 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.1 t60 -66.98 -42.97 84.19 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.141 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.717 ' CD2' HG22 ' A' ' 100' ' ' VAL . 4.3 m-30 -70.32 -31.47 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 178.03 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.612 ' HD1' ' HE1' ' A' ' 141' ' ' PHE . 57.6 t80 -67.59 -53.28 29.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -80.62 -13.85 58.69 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.581 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.462 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.6 tpt -44.23 -40.0 4.84 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.752 0.821 . . . . 0.0 112.401 -170.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.671 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -146.49 10.41 1.09 Allowed 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.944 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.625 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.4 t70 -84.63 85.15 7.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.408 0.623 . . . . 0.0 109.764 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' TYR . . . . . 0.671 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 69.5 m-85 -104.14 -6.66 20.84 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.511 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 p30 -77.76 -13.86 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.203 0.525 . . . . 0.0 110.943 -178.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 67.34 26.86 73.47 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.554 -0.748 . . . . 0.0 113.161 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -99.98 -2.87 33.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 117.464 0.632 . . . . 0.0 110.462 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 63.12 31.89 15.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.349 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.547 HD22 ' HB2' ' A' ' 135' ' ' TYR . 15.8 mt -141.89 141.09 33.02 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.529 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.728 ' HB2' HG22 ' A' ' 136' ' ' ILE . 4.0 mm? -95.36 109.25 21.44 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -83.95 161.88 20.64 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.784 175.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.96 -48.5 24.85 Favored Glycine 0 C--O 1.23 -0.15 0 CA-C-O 119.782 -0.455 . . . . 0.0 113.842 -178.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.723 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.1 pp -68.48 -32.27 72.15 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 117.409 0.604 . . . . 0.0 111.592 -175.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.723 ' N ' HD12 ' A' ' 91' ' ' LEU . 50.4 mt-10 -71.25 -58.78 3.22 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.555 1.169 . . . . 0.0 108.272 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 1.118 ' HG ' HG12 ' A' ' 97' ' ' ILE . 12.3 tp -60.84 -11.5 7.96 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 112.897 -1.956 . . . . 0.0 111.466 -174.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.846 ' HA ' HD13 ' A' ' 121' ' ' ILE . 7.9 m -52.72 -32.28 42.13 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.448 0.699 . . . . 0.0 112.71 178.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.0 -35.2 15.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.958 178.006 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.714 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -75.36 -41.3 56.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.276 -170.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 1.118 HG12 ' HG ' ' A' ' 93' ' ' LEU . 26.8 mm -60.07 -19.89 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -174.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.692 HG23 HD21 ' A' ' 117' ' ' LEU . 4.4 m -55.25 -27.94 49.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.35 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 58.6 m-70 -107.93 -18.08 13.89 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.929 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.717 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.3 t -84.99 -53.52 10.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.531 -174.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' HIS . . . . . 0.679 ' CD2' ' HB2' ' A' ' 103' ' ' GLU . 21.2 t60 -66.98 98.31 0.55 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 178.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.53 ' HB2' ' HA ' ' A' ' 106' ' ' SER . 22.1 pttm -75.43 77.93 2.49 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.662 0.744 . . . . 0.0 111.774 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.679 ' HB2' ' CD2' ' A' ' 101' ' ' HIS . 10.3 tp10 -88.47 -48.09 7.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.342 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -96.2 -68.65 0.79 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.918 -178.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -97.67 -153.71 29.18 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 170.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.53 ' HA ' ' HB2' ' A' ' 102' ' ' LYS . 49.4 m -106.02 -83.15 0.52 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.517 0.659 . . . . 0.0 110.154 174.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -76.15 -6.99 53.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.284 0.564 . . . . 0.0 110.689 173.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.467 ' O ' ' HD3' ' A' ' 110' ' ' PRO . 59.6 mt-30 -71.46 137.78 48.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.566 179.266 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.561 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -83.31 111.85 34.41 Favored Pre-proline 0 CA--C 1.511 -0.521 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.572 173.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' PRO . . . . . 0.467 ' HD3' ' O ' ' A' ' 108' ' ' GLN . 2.3 Cg_endo -80.81 69.64 7.87 Favored 'Trans proline' 0 N--CA 1.441 -1.589 0 C-N-CA 121.795 1.663 . . . . 0.0 111.197 174.235 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.9 75.34 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.015 0.912 . . . . 0.0 110.734 171.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.402 ' HG2' ' H ' ' A' ' 112' ' ' MET . 12.8 ptt? -95.26 -58.01 2.25 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.04 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 13.7 m -160.99 127.24 3.93 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 176.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.594 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.72 -38.38 64.26 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.805 -178.011 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.504 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 20.7 t70 -64.8 -46.22 82.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.27 0.557 . . . . 0.0 110.861 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.57 -38.66 91.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.291 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.692 HD21 HG23 ' A' ' 98' ' ' THR . 6.7 tp -63.85 -32.12 73.53 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.309 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.594 HG13 ' O ' ' A' ' 114' ' ' GLU . 73.9 mt -59.36 -45.48 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.129 174.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -64.29 -38.17 90.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.3 0.572 . . . . 0.0 110.039 175.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.547 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.3 mp -58.51 -46.67 89.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.068 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.846 HD13 ' HA ' ' A' ' 94' ' ' SER . 71.4 mt -62.9 -45.49 98.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 0.0 110.39 177.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . 0.517 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.6 t70 -57.77 -44.94 86.51 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.12 52.52 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.691 177.516 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.944 HG21 HD12 ' A' ' 97' ' ' ILE . 46.2 t -65.3 -54.77 25.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.805 174.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.92 -7.25 26.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.193 0.52 . . . . 0.0 111.441 -176.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 9.9 mtt180 -107.74 -36.04 6.52 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.834 -178.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -127.12 -41.79 1.75 Allowed 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.54 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 1.3 m-20 -71.73 -18.47 62.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.497 0.665 . . . . 0.0 110.22 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.596 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 2.2 t70 -77.81 93.12 4.29 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 165.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -79.09 -21.46 46.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.039 -169.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.63 -4.54 53.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -176.248 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ASN . . . . . 0.421 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 20.3 m120 61.25 34.78 18.52 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.379 -177.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -93.42 -15.16 25.93 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.767 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.3 -2.89 75.34 Favored Glycine 0 N--CA 1.453 -0.17 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.965 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' TYR . . . . . 0.547 ' HB2' HD22 ' A' ' 87' ' ' LEU . 45.5 m-85 -129.35 164.86 22.67 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 120.971 0.415 . . . . 0.0 110.005 178.308 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.728 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.4 tt -106.34 126.59 62.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.509 175.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.575 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 0.2 OUTLIER -103.23 178.96 4.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.304 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 138' ' ' TYR . . . . . 0.811 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.9 t80 -53.02 -48.02 67.88 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.363 0.414 . . . . 0.0 111.264 -176.21 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.65 -30.02 69.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.963 0.411 . . . . 0.0 111.491 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLU . . . . . 0.596 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.1 mt-10 -73.92 -50.79 18.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.251 -177.149 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' PHE . . . . . 0.811 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -74.7 -25.49 59.18 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.596 178.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.97 -43.03 91.31 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.129 0.49 . . . . 0.0 110.102 175.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.421 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 34.5 mtmm -74.72 -28.44 60.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.745 176.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' SER . . . . . 0.469 ' O ' ' HG2' ' A' ' 102' ' ' LYS . 23.2 t -78.55 -43.04 27.64 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.065 -171.326 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.565 HD21 ' HG2' ' A' ' 73' ' ' GLN . 2.8 pp -84.24 -7.4 59.35 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.943 0.401 . . . . 0.0 111.387 -175.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.833 -178.123 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.622 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.3 mmm . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.655 0.264 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.647 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 41.0 t -88.01 147.82 41.7 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.175 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.66 -44.11 37.1 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.002 2.468 . . . . 0.0 114.125 -174.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.59 ' HA ' HE21 ' A' ' 73' ' ' GLN . 7.3 pt20 -56.81 -52.91 63.21 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.676 -177.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.647 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.1 pt-20 -73.1 -26.45 61.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.493 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.622 HD21 ' HB2' ' A' ' 67' ' ' MET . 18.0 mt -65.57 -17.68 64.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.717 0.294 . . . . 0.0 111.294 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.59 HE21 ' HA ' ' A' ' 70' ' ' GLN . 43.1 mt-30 -69.93 -47.28 63.01 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 172.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.2 tp -66.3 -19.64 65.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.582 174.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.545 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 26.6 t60 -68.19 -41.84 80.82 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.718 175.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.692 ' CD2' HG22 ' A' ' 100' ' ' VAL . 4.8 m-30 -66.49 -28.53 68.65 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.934 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 64.8 t80 -73.29 -53.87 9.77 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.649 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.481 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -79.62 -12.99 59.81 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.206 -175.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.403 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.1 tpt -44.52 -41.3 6.31 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.839 0.712 . . . . 0.0 111.901 -174.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.506 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -140.81 9.91 2.19 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.863 179.573 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.524 ' HB2' HD21 ' A' ' 88' ' ' LEU . 27.3 t70 -86.26 88.81 7.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 110.268 178.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.506 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 21.7 m-85 -106.14 14.53 27.56 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.37 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -112.94 -15.41 12.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.319 -176.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 60.23 27.24 64.97 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.743 -0.662 . . . . 0.0 114.426 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -89.3 3.33 52.48 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 117.766 0.783 . . . . 0.0 110.765 -178.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.934 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 2.6 t30 68.84 20.3 8.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.425 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.534 HD22 ' HB2' ' A' ' 135' ' ' TYR . 40.8 mt -143.27 158.47 43.6 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.574 0.702 . . . . 0.0 111.248 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.589 HD11 ' HA ' ' A' ' 77' ' ' PHE . 70.6 mt -125.78 118.12 24.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.391 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.57 169.66 12.57 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.94 -35.69 54.16 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.403 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.5 mt -59.07 -42.8 91.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.262 0.553 . . . . 0.0 110.594 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.421 ' HA ' ' ND1' ' A' ' 80' ' ' HIS . 37.3 mt-10 -70.76 -50.59 34.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.035 0.921 . . . . 0.0 109.203 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 97' ' ' ILE . 29.4 mt -65.77 -12.22 52.17 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.733 -171.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.717 ' HA ' HD13 ' A' ' 121' ' ' ILE . 24.4 p -55.61 -31.95 62.7 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.545 0.212 . . . . 0.0 111.4 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.83 -36.82 14.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.234 0.54 . . . . 0.0 111.145 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.57 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.2 -43.91 20.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.744 -168.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.894 HD12 HG21 ' A' ' 124' ' ' VAL . 32.6 mm -62.82 -20.52 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.673 -174.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.713 HG23 HD21 ' A' ' 117' ' ' LEU . 17.5 m -56.39 -21.3 24.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.488 174.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -108.67 -44.5 4.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.207 174.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.692 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.9 t -59.16 -48.79 85.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.67 -173.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . 0.47 ' CD2' HG13 ' A' ' 120' ' ' ILE . 27.8 t60 . . . . . 0 N--CA 1.449 -0.522 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.765 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.507 -0.695 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 3.4 Cg_exo -79.41 67.73 8.51 Favored 'Trans proline' 0 N--CA 1.439 -1.702 0 C-N-CA 121.496 1.464 . . . . 0.0 111.379 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.71 83.47 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.945 0.879 . . . . 0.0 110.779 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.456 ' H ' ' HG2' ' A' ' 112' ' ' MET . 12.8 ptt? -102.95 -54.24 2.67 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.837 -176.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.7 m -161.38 119.15 2.31 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.62 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.04 -40.67 67.29 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.466 ' HA ' HD12 ' A' ' 118' ' ' ILE . 33.9 m-20 -71.9 -40.67 68.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.793 0.33 . . . . 0.0 110.926 -178.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -63.89 -37.02 85.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.469 0.652 . . . . 0.0 109.357 173.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.713 HD21 HG23 ' A' ' 98' ' ' THR . 12.5 tp -65.93 -31.97 73.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.066 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 114' ' ' GLU . 88.1 mt -61.18 -45.19 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.895 0.379 . . . . 0.0 110.249 174.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -66.76 -31.79 72.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.844 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.571 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -62.31 -42.57 95.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.202 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.887 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.3 mt -64.59 -48.27 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.903 176.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 70.6 m-20 -50.81 -48.17 59.78 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.25 -28.42 34.66 Favored Glycine 0 C--O 1.224 -0.471 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.491 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.894 HG21 HD12 ' A' ' 97' ' ' ILE . 54.9 t -72.08 -55.04 14.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 O-C-N 122.708 -0.289 . . . . 0.0 111.125 174.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.8 mp -65.92 -13.98 60.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.313 0.578 . . . . 0.0 111.044 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 47.7 mtt180 -110.48 -29.59 8.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.881 -175.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -125.91 -46.44 1.69 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.549 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 19.3 m-20 -68.06 -22.52 64.93 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 121.243 0.544 . . . . 0.0 110.275 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.486 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 0.8 OUTLIER -76.09 99.53 4.67 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.818 168.626 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -80.75 -17.43 51.0 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.657 -171.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.88 -0.08 43.11 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.531 -173.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.6 m120 61.75 37.53 15.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.996 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -99.6 -19.62 16.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.52 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 85.87 6.54 82.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.436 178.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.534 ' HB2' HD22 ' A' ' 87' ' ' LEU . 50.9 m-85 -126.78 160.74 29.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.501 HG22 ' HB2' ' A' ' 88' ' ' LEU . 7.3 tt -110.86 117.39 54.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.082 0.944 . . . . 0.0 110.568 178.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -90.33 168.64 11.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.258 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.797 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 7.3 t80 -51.83 -47.24 64.43 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.37 -26.49 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.04 0.447 . . . . 0.0 110.984 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.486 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 44.2 mt-10 -76.12 -53.31 8.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.97 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.797 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -72.49 -26.39 61.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.587 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.71 -42.42 97.19 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 174.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.428 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.5 mtmm -71.57 -28.92 64.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.781 176.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.1 t -80.21 -39.09 29.83 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.727 -172.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.991 -178.111 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.63 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.1 mmm . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 120.653 0.263 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -91.74 156.58 42.67 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.858 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.42 -50.75 12.82 Favored 'Trans proline' 0 N--CA 1.475 0.436 0 C-N-CA 122.85 2.367 . . . . 0.0 114.146 -173.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -62.45 -42.76 99.7 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.765 -174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 17.5 pt-20 -77.6 -27.33 51.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.63 HD21 ' HB2' ' A' ' 67' ' ' MET . 13.5 mt -68.23 -17.96 64.44 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 120.745 0.307 . . . . 0.0 111.479 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.491 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 16.2 mt-30 -70.76 -45.74 64.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 171.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.76 -20.62 66.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.641 173.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.525 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 62.3 t60 -68.7 -33.24 73.61 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.385 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.429 ' HD1' HG22 ' A' ' 100' ' ' VAL . 4.3 m-30 -72.12 -31.51 66.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 175.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.659 ' HB2' ' HZ ' ' A' ' 141' ' ' PHE . 47.6 t80 -69.03 -53.2 21.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.284 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.57 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.56 -10.4 59.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.678 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.497 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 4.8 tpt -44.08 -39.43 4.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.904 0.881 . . . . 0.0 112.749 -171.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.518 ' O ' ' HG3' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -144.74 10.21 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.344 -178.92 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.795 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.5 t70 -74.83 94.84 2.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.617 0.722 . . . . 0.0 110.819 -176.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -122.02 18.83 10.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.652 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -108.08 -13.67 14.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -178.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 70.74 15.25 73.45 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.509 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -95.13 -4.85 45.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.657 0.728 . . . . 0.0 111.012 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.409 ' O ' HD22 ' A' ' 87' ' ' LEU . 47.2 m-80 62.69 19.76 11.6 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.691 177.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.537 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.4 mm? -129.14 163.31 25.79 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.656 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 86.9 mt -120.09 113.74 20.93 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 121.212 -0.195 . . . . 0.0 110.685 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.508 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 0.0 OUTLIER -86.25 175.66 8.35 Favored 'General case' 0 C--O 1.209 -1.059 0 O-C-N 123.794 0.684 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.44 -53.72 23.41 Favored Glycine 0 CA--C 1.518 0.232 0 N-CA-C 114.548 0.579 . . . . 0.0 114.548 -176.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.618 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.9 pp -80.33 -28.63 38.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.574 0.687 . . . . 0.0 111.573 -172.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.795 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 40.7 tt0 -70.54 -51.45 28.61 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.891 0.853 . . . . 0.0 108.866 173.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 1.025 ' HG ' HG12 ' A' ' 97' ' ' ILE . 17.1 tp -65.95 -12.57 55.81 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.018 -179.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.805 ' HA ' HD13 ' A' ' 121' ' ' ILE . 28.0 m -52.96 -31.89 42.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.187 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 m -87.71 -22.26 24.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.07 0.462 . . . . 0.0 111.287 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.795 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -93.08 -39.18 11.22 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -171.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 1.025 HG12 ' HG ' ' A' ' 93' ' ' LEU . 43.6 mm -64.83 -21.55 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-O 120.962 0.41 . . . . 0.0 110.777 -179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.866 HG23 HD21 ' A' ' 117' ' ' LEU . 3.4 m -57.9 -24.77 59.21 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -111.78 -27.55 8.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.986 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.769 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 40.5 t -61.7 -59.81 3.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 175.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 49.4 t60 . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 121.312 0.577 . . . . 0.0 110.11 174.708 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.865 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.504 -0.812 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . 0.461 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.2 Cg_endo -79.84 67.1 8.72 Favored 'Trans proline' 0 N--CA 1.438 -1.748 0 C-N-CA 121.343 1.362 . . . . 0.0 111.625 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.21 78.97 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 122.144 0.973 . . . . 0.0 110.37 172.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.472 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.4 ptt? -97.76 -56.39 2.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.063 -1.426 . . . . 0.0 110.671 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.0 m -155.62 119.31 4.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.439 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.8 pt-20 -56.9 -37.5 71.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.868 -170.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.53 -45.23 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.451 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.53 -39.43 94.4 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.265 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.866 HD21 HG23 ' A' ' 98' ' ' THR . 13.2 tp -62.23 -38.36 88.93 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.288 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 114' ' ' GLU . 76.5 mt -63.46 -41.88 94.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 174.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -67.26 -30.6 70.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.307 0.575 . . . . 0.0 110.16 175.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.425 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -63.36 -43.0 98.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.1 173.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.805 HD13 ' HA ' ' A' ' 94' ' ' SER . 82.0 mt -63.79 -47.35 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.646 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.722 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 0.5 OUTLIER -52.52 -47.74 66.47 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.363 176.216 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.19 -34.38 53.22 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.18 -0.533 . . . . 0.0 111.903 177.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 52.5 t -65.78 -52.07 54.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.621 0.248 . . . . 0.0 110.661 175.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.425 HD11 HD23 ' A' ' 93' ' ' LEU . 8.9 mp -67.74 -1.05 4.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.67 -177.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.722 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.9 mtm180 -118.2 -32.62 4.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.605 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -123.77 -45.51 2.03 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -176.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.526 ' HB2' HG13 ' A' ' 124' ' ' VAL . 4.4 m-20 -71.97 -17.05 62.09 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.132 0.492 . . . . 0.0 110.4 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.577 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.8 t70 -76.36 93.25 3.44 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 166.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -79.37 -17.59 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.604 -168.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.45 8.07 16.42 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.244 -170.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.421 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 15.1 m120 61.02 36.2 18.62 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.984 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.7 p30 -98.38 -4.12 35.47 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.784 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.2 -16.27 23.86 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.986 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.537 ' HB2' HD12 ' A' ' 87' ' ' LEU . 16.5 m-85 -116.21 173.94 6.32 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.543 HD13 ' HB3' ' A' ' 141' ' ' PHE . 7.1 tt -108.7 121.98 62.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.705 177.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -91.58 170.11 10.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.345 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.769 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 38.1 t80 -52.33 -48.77 65.28 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.113 0.258 . . . . 0.0 110.63 -178.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.6 -28.01 69.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.928 0.394 . . . . 0.0 111.686 -176.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.577 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 47.7 mt-10 -76.98 -49.21 15.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.481 -173.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.769 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -76.29 -27.99 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.534 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.99 88.01 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.853 0.359 . . . . 0.0 110.553 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.412 ' HE3' ' HB2' ' A' ' 143' ' ' LYS . 47.6 mtmt -77.42 -29.01 52.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.527 175.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 21.7 t -75.58 -34.55 60.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.481 -175.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 pp . . . . . 0 CA--C 1.53 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.464 -178.806 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.647 ' HB2' HD21 ' A' ' 72' ' ' LEU . 96.9 mmm . . . . . 0 N--CA 1.463 0.194 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.449 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 55.3 m -116.8 162.99 24.38 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.451 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 81.1 Cg_exo -50.35 -49.33 16.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.284 2.656 . . . . 0.0 115.222 -172.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.403 ' HG3' ' OE1' ' A' ' 71' ' ' GLU . 3.3 pt20 -59.31 -48.68 80.73 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -172.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.449 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 1.7 pm0 -72.98 -28.65 62.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.707 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 67' ' ' MET . 27.6 mt -68.09 -17.62 64.43 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.166 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.451 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 28.7 mt-30 -69.59 -47.46 63.46 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.91 -19.36 65.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.697 173.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.571 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 25.1 t60 -71.57 -42.29 68.0 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.908 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.793 ' CD2' HG22 ' A' ' 100' ' ' VAL . 7.4 m-30 -66.95 -29.09 68.86 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.557 ' HA ' HD11 ' A' ' 88' ' ' LEU . 58.0 t80 -73.01 -50.39 23.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.864 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.453 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.3 mmmt -80.94 -26.62 36.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -175.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.3 tpp -44.72 -53.94 6.79 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -170.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.469 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -122.54 9.18 9.6 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.438 -174.532 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.673 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.0 t70 -83.89 72.8 10.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 109.554 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.423 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.8 OUTLIER -98.17 -7.02 30.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.915 -178.461 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -77.22 -13.65 59.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.8 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.3 24.06 74.19 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.414 -0.812 . . . . 0.0 113.381 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.476 ' ND2' ' HB2' ' A' ' 87' ' ' LEU . 14.1 p-10 -104.57 -9.71 18.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 117.64 0.72 . . . . 0.0 111.719 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.8 m120 67.71 30.21 6.54 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.57 HD22 ' HB2' ' A' ' 135' ' ' TYR . 13.6 mt -138.47 163.95 30.63 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.298 -0.865 . . . . 0.0 108.939 172.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.557 HD11 ' HA ' ' A' ' 77' ' ' PHE . 84.2 mt -125.86 117.51 23.52 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 123.23 0.331 . . . . 0.0 110.974 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.598 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.7 p30 -98.87 -170.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.317 177.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.12 -50.22 56.36 Favored Glycine 0 C--N 1.329 0.177 0 N-CA-C 114.32 0.488 . . . . 0.0 114.32 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.694 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.7 pp -75.0 -29.48 60.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.52 0.66 . . . . 0.0 110.749 -173.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.694 ' N ' HD12 ' A' ' 91' ' ' LEU . 47.9 mt-10 -68.8 -50.04 53.55 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 97' ' ' ILE . 40.8 mt -66.82 -13.17 61.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.959 -178.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.649 ' HA ' HD13 ' A' ' 121' ' ' ILE . 48.4 m -57.39 -32.24 66.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.646 0.26 . . . . 0.0 111.321 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 m -92.39 -33.45 14.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 110.883 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.681 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.98 -51.08 8.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.091 -169.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.867 HD12 HG21 ' A' ' 124' ' ' VAL . 24.3 mm -57.66 -24.68 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.908 -174.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.637 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 4.2 m -58.4 -22.14 52.91 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.188 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.511 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 43.8 m-70 -106.67 -19.84 13.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.826 174.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.793 HG22 ' CD2' ' A' ' 76' ' ' TYR . 12.4 t -86.01 -60.14 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -170.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . 0.43 ' CD2' HG13 ' A' ' 120' ' ' ILE . 74.1 t60 . . . . . 0 C--O 1.235 0.3 0 O-C-N 123.373 0.42 . . . . 0.0 111.766 -170.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.492 ' HB2' ' CE1' ' A' ' 99' ' ' HIS . . . . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 110.462 -0.199 . . . . 0.0 110.462 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . 0.637 ' HD2' ' O ' ' A' ' 98' ' ' THR . 45.4 Cg_endo -71.02 63.94 2.53 Favored 'Trans proline' 0 N--CA 1.455 -0.735 0 C-N-CA 122.11 1.873 . . . . 0.0 111.769 170.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.94 79.03 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.742 0.782 . . . . 0.0 111.299 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.405 ' H ' ' HG2' ' A' ' 112' ' ' MET . 18.3 ptt? -90.55 -59.16 2.25 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.67 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 75.4 m -167.36 129.93 1.68 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.596 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.4 OUTLIER -62.18 -28.26 69.54 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 123.264 0.352 . . . . 0.0 111.861 -175.028 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.71 -42.42 70.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -64.14 -40.71 96.74 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.506 HD11 ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER -62.76 -36.26 82.49 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.919 -1.492 . . . . 0.0 110.563 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.596 HG13 ' O ' ' A' ' 114' ' ' GLU . 68.6 mt -60.37 -43.48 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.904 0.383 . . . . 0.0 110.374 175.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.61 -38.32 87.19 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.606 0.717 . . . . 0.0 109.648 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.467 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -64.22 -39.99 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.3 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.805 ' HA ' HG21 ' A' ' 97' ' ' ILE . 79.2 mt -65.71 -41.82 91.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.466 178.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.767 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.1 t70 -62.94 -43.3 99.18 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.15 -30.39 57.66 Favored Glycine 0 C--O 1.224 -0.498 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.276 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 45.6 t -65.43 -49.28 79.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.747 0.308 . . . . 0.0 110.932 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 134' ' ' GLY . 96.2 mt -67.82 -9.89 48.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.995 0.426 . . . . 0.0 111.195 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.767 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.4 mtp85 -107.93 -34.78 6.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.308 -178.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -121.62 -47.31 2.22 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -171.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.539 ' HB2' HG13 ' A' ' 124' ' ' VAL . 15.1 m-20 -71.94 -21.11 61.65 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.058 0.456 . . . . 0.0 110.788 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.537 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.2 t70 -76.66 91.44 3.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 168.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -78.43 -18.25 55.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.627 -167.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -117.25 16.02 14.87 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.789 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 56.84 44.16 23.74 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.563 170.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.08 -15.46 15.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.692 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.407 ' O ' HD22 ' A' ' 125' ' ' LEU . . . 87.82 1.97 82.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.203 176.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.57 ' HB2' HD22 ' A' ' 87' ' ' LEU . 45.9 m-85 -132.74 170.88 14.62 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.499 HG22 HD21 ' A' ' 93' ' ' LEU . 7.1 tt -111.35 122.49 65.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.331 0.586 . . . . 0.0 109.739 174.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -103.3 -177.04 3.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.099 176.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.851 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.3 t80 -55.04 -48.99 72.7 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.551 0.532 . . . . 0.0 111.694 -171.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -23.18 64.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.004 0.43 . . . . 0.0 111.464 -175.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.537 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 51.7 mt-10 -80.69 -53.11 6.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -174.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.851 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.8 p90 -68.88 -32.11 71.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.047 177.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.77 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.998 0.428 . . . . 0.0 110.671 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -72.72 -29.34 63.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.38 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 9.0 t -79.84 -25.47 40.77 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -174.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.827 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 76.5 mt . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.311 176.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.652 ' HB2' HD21 ' A' ' 72' ' ' LEU . 93.5 mmm . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.828 0.347 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.545 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 5.8 m -85.53 153.83 58.84 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.874 177.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.604 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 18.9 Cg_endo -59.77 -26.96 83.8 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.463 2.775 . . . . 0.0 114.698 -169.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.436 ' HG3' ' H ' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -68.68 -54.92 13.35 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 121.421 0.629 . . . . 0.0 109.939 -177.155 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.545 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 1.7 pm0 -67.85 -27.04 66.35 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.249 174.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.751 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 15.1 mt -65.88 -20.62 66.29 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.403 177.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.768 ' HG2' HD13 ' A' ' 145' ' ' LEU . 20.8 mt-30 -72.22 -40.83 67.5 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.01 -24.38 65.11 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.751 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 18.0 t60 -68.92 -39.17 79.78 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.096 176.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.77 ' CD2' HG22 ' A' ' 100' ' ' VAL . 3.9 m-30 -66.94 -34.95 78.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.279 0.561 . . . . 0.0 109.813 175.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.54 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 59.1 t80 -68.48 -53.35 23.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.24 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.405 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 28.0 mmmt -80.28 -12.33 59.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.61 -175.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.49 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.4 tpt -44.62 -38.89 4.59 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.928 0.768 . . . . 0.0 112.435 -172.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.622 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 1.0 OUTLIER -146.5 11.49 1.14 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.293 -179.645 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.743 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 25.0 t70 -82.56 90.9 6.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.614 0.721 . . . . 0.0 110.326 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -105.01 -10.84 16.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.4 p30 -83.89 -13.7 52.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.606 -173.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 64.09 24.43 68.7 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.358 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -95.07 5.12 52.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.343 0.572 . . . . 0.0 111.018 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.54 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 19.6 m120 59.19 32.34 21.96 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.129 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 27.5 mt -151.31 160.14 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.63 178.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.602 ' HB2' HG22 ' A' ' 136' ' ' ILE . 60.7 mt -121.32 123.54 42.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.503 176.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.578 ' OD2' ' HG ' ' A' ' 91' ' ' LEU . 0.1 OUTLIER -92.37 177.81 6.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.583 176.71 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.27 -34.71 54.09 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.206 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.578 ' HG ' ' OD2' ' A' ' 89' ' ' ASP . 27.7 mt -71.08 -47.05 60.49 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.176 0.512 . . . . 0.0 110.099 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.743 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 50.6 mt-10 -62.45 -41.59 98.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.547 0.689 . . . . 0.0 109.586 174.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.677 ' HB3' HG12 ' A' ' 97' ' ' ILE . 34.1 mt -68.44 -15.03 63.4 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.744 -175.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.777 ' HA ' HD13 ' A' ' 121' ' ' ILE . 26.6 t -59.9 -32.48 70.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.074 0.464 . . . . 0.0 110.445 178.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 -30.26 17.78 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.393 0.616 . . . . 0.0 110.382 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.573 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -86.22 -55.49 3.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.969 -171.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.949 HD12 HG21 ' A' ' 124' ' ' VAL . 33.6 mm -59.03 -25.22 29.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 122.731 0.412 . . . . 0.0 111.793 -174.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.686 HG23 HD21 ' A' ' 117' ' ' LEU . 23.4 m -59.38 -16.06 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.219 0.533 . . . . 0.0 110.867 175.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 43.4 m-70 -110.77 -23.31 11.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.499 174.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.77 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.1 t -85.19 -45.9 17.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.731 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . 0.457 ' CD2' HG13 ' A' ' 120' ' ' ILE . 35.6 t60 . . . . . 0 N--CA 1.451 -0.38 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.838 -176.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.584 ' HA ' ' O ' ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.506 -0.738 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -85.06 69.36 5.69 Favored 'Trans proline' 0 N--CA 1.434 -1.98 0 C-N-CA 121.738 1.626 . . . . 0.0 110.711 176.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.8 mt -61.07 78.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.958 0.885 . . . . 0.0 111.04 174.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.486 ' H ' ' HG2' ' A' ' 112' ' ' MET . 11.6 ptt? -92.74 -56.97 2.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.474 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.9 m -158.61 125.76 4.89 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.421 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.52 -37.86 68.46 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.036 -176.546 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -60.24 -49.24 78.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.435 0.636 . . . . 0.0 110.11 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.13 -41.21 90.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.922 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.686 HD21 HG23 ' A' ' 98' ' ' THR . 8.1 tp -60.79 -39.69 89.82 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.561 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 114' ' ' GLU . 43.5 mt -59.01 -44.27 90.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.636 176.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -69.77 -31.61 69.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.645 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.457 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.2 mp -60.85 -46.5 96.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.125 174.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.912 ' HA ' HG21 ' A' ' 97' ' ' ILE . 83.9 mt -63.03 -47.26 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.251 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.808 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.8 t70 -60.5 -42.27 96.01 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.729 -179.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.49 -32.79 46.27 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.401 176.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.949 HG21 HD12 ' A' ' 97' ' ' ILE . 30.4 t -61.6 -51.1 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.7 0.286 . . . . 0.0 110.426 173.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.44 HD11 HD12 ' A' ' 93' ' ' LEU . 7.8 mp -66.54 -10.81 48.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.129 0.49 . . . . 0.0 110.993 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.808 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 25.8 mtp180 -99.67 -32.96 10.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.568 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -136.5 -43.28 0.61 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -171.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.653 ' HB3' HG13 ' A' ' 124' ' ' VAL . 32.0 t0 -72.95 -22.15 60.76 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.383 0.611 . . . . 0.0 110.554 -176.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.26 101.18 6.13 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 168.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -78.42 -29.96 47.39 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.25 -168.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.02 -4.12 59.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.944 -174.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 59.11 36.43 24.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.741 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -96.81 -20.78 17.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.117 -176.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 106.24 -20.46 35.27 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.857 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -114.71 161.58 17.95 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.071 0.462 . . . . 0.0 110.554 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.602 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.5 tt -107.04 125.88 63.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.411 175.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -104.13 -176.86 3.2 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.822 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 10.8 t80 -54.49 -43.66 71.97 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.441 0.463 . . . . 0.0 111.494 -174.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.82 -37.05 81.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.577 0.227 . . . . 0.0 111.227 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.48 ' OE1' ' HA ' ' A' ' 136' ' ' ILE . 50.7 mt-10 -71.45 -53.4 14.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.986 -171.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.822 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -70.04 -23.17 63.06 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.825 -178.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.611 ' HA ' HD12 ' A' ' 145' ' ' LEU . . . -79.65 -32.89 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.204 0.526 . . . . 0.0 110.496 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -69.55 -33.01 72.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.022 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 1.4 p -81.95 -30.57 31.66 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.768 HD13 ' HG2' ' A' ' 73' ' ' GLN . 6.7 mt . . . . . 0 C--O 1.233 0.222 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.149 170.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.629 ' HB2' HD21 ' A' ' 72' ' ' LEU . 97.2 mmm . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.473 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 20.3 m -93.54 158.23 37.14 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.912 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.541 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.4 Cg_exo -51.5 -45.68 36.18 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.129 2.552 . . . . 0.0 114.312 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -57.24 -54.73 43.52 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.023 -173.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.473 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 3.6 pm0 -71.16 -33.3 69.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.88 177.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.656 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 13.9 mt -62.72 -21.06 65.51 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.319 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.803 ' HG2' HD21 ' A' ' 145' ' ' LEU . 16.5 mt-30 -67.17 -48.03 69.21 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 173.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.2 tp -64.04 -22.34 66.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.526 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.656 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 36.0 t60 -72.01 -43.24 65.36 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.131 178.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.562 ' CE2' HD22 ' A' ' 145' ' ' LEU . 5.3 m-30 -62.82 -32.97 74.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 176.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 32.5 t80 -70.96 -52.65 18.56 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.206 -1.361 . . . . 0.0 110.46 -178.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -79.89 -21.31 44.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.717 -175.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 19.1 tpp -44.95 -52.99 8.17 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 123.796 0.685 . . . . 0.0 112.2 -173.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.672 ' HA ' ' CE2' ' A' ' 82' ' ' TYR . 1.8 m170 -122.94 9.88 9.44 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.008 -175.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.566 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.0 t70 -82.69 56.01 3.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.78 0.8 . . . . 0.0 109.917 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.672 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 47.5 m-85 -71.95 -23.97 61.53 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.713 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.8 p30 -71.83 -14.88 62.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.685 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.74 28.27 65.33 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.132 -0.94 . . . . 0.0 113.491 177.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -96.07 3.81 53.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.498 0.649 . . . . 0.0 111.775 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.491 ' HA ' ' CZ ' ' A' ' 77' ' ' PHE . 12.5 m120 65.61 25.18 11.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.216 0.532 . . . . 0.0 111.492 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.487 HD22 ' HB2' ' A' ' 135' ' ' TYR . 13.4 mt -147.19 156.5 43.02 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.682 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.621 ' HB2' HG22 ' A' ' 136' ' ' ILE . 75.8 mt -123.74 121.16 34.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.9 0.381 . . . . 0.0 111.536 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.472 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 13.4 t70 -83.21 168.29 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.394 173.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.51 55.21 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.609 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.472 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.4 mt -61.55 -43.31 99.09 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.491 0.662 . . . . 0.0 110.442 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.566 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.0 mt-10 -67.43 -46.53 72.88 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.959 0.885 . . . . 0.0 109.111 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.788 ' HB3' HG12 ' A' ' 97' ' ' ILE . 24.5 mt -66.61 -9.95 40.77 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.379 -173.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.693 ' HA ' HD13 ' A' ' 121' ' ' ILE . 36.2 t -54.4 -34.73 61.88 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.642 0.258 . . . . 0.0 111.301 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m -91.19 -30.99 16.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.395 -0.522 . . . . 0.0 111.244 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.59 -46.07 14.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.828 -171.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.855 HG21 ' HA ' ' A' ' 121' ' ' ILE . 43.6 mm -65.16 -22.18 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.364 -175.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.69 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 11.2 m -62.73 -15.27 52.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.44 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 61.9 m-70 -114.91 -25.76 8.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 174.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.707 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 58.7 t -66.3 -60.77 2.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.525 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 78.1 t60 . . . . . 0 C--O 1.233 0.237 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.908 -179.186 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.502 -0.882 0 N-CA-C 110.41 -0.218 . . . . 0.0 110.41 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . 0.69 ' HD2' ' O ' ' A' ' 98' ' ' THR . 57.3 Cg_endo -74.99 71.73 4.89 Favored 'Trans proline' 0 N--CA 1.443 -1.466 0 C-N-CA 121.273 1.315 . . . . 0.0 111.82 174.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.67 76.15 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.669 0.747 . . . . 0.0 110.623 170.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 22.5 ptt? -89.55 -59.23 2.27 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.398 -177.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.7 m -163.04 117.49 1.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.482 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.47 -35.29 65.36 Favored 'General case' 0 C--O 1.219 -0.504 0 O-C-N 123.739 0.649 . . . . 0.0 112.03 -174.27 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -65.15 -47.05 78.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.114 0.483 . . . . 0.0 110.53 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.9 -38.62 79.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.682 176.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.429 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.1 tm? -58.0 -39.62 78.71 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.947 177.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 114' ' ' GLU . 39.9 mt -60.6 -46.02 96.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.067 175.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -64.7 -33.49 76.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.298 0.571 . . . . 0.0 110.209 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.3 mp -61.62 -47.92 91.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.437 175.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.855 ' HA ' HG21 ' A' ' 97' ' ' ILE . 70.4 mt -61.92 -43.96 98.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.64 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.653 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.6 t70 -63.08 -39.58 95.12 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.821 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.67 -28.84 60.51 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.911 177.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.826 HG21 HD12 ' A' ' 97' ' ' ILE . 45.5 t -61.8 -51.04 77.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.839 0.352 . . . . 0.0 110.918 174.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.38 -13.07 61.68 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.168 0.509 . . . . 0.0 110.9 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.653 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.6 mtm-85 -94.71 -50.06 5.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.626 -177.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -125.58 -31.61 2.96 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -173.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.549 ' CB ' ' HA ' ' A' ' 124' ' ' VAL . 9.6 t0 -75.14 -23.43 57.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.177 0.513 . . . . 0.0 110.637 -174.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.07 103.97 4.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 167.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -81.79 -18.66 43.33 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.417 -174.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . 0.486 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.1 m120 -83.3 -14.23 53.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.234 -172.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 131' ' ' ASN . 26.8 m-80 67.59 34.42 4.57 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.811 0.694 . . . . 0.0 110.365 -173.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.486 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -102.01 -21.36 14.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.8 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.27 4.61 77.29 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.466 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.487 ' HB2' HD22 ' A' ' 87' ' ' LEU . 59.6 m-85 -127.65 167.84 15.86 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.621 HG22 ' HB2' ' A' ' 88' ' ' LEU . 4.6 tt -107.86 122.69 62.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.93 0.872 . . . . 0.0 110.498 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -95.48 166.46 11.85 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.364 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.814 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 14.9 t80 -48.37 -47.68 37.21 Favored 'General case' 0 CA--C 1.523 -0.07 0 O-C-N 123.065 0.228 . . . . 0.0 110.869 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.386 -178.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.02 -50.27 64.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.89 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.814 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.2 p90 -74.03 -34.27 64.05 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.71 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.57 84.55 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.993 0.425 . . . . 0.0 110.239 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -72.2 -31.61 66.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.094 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 41.6 t -84.59 -37.04 21.63 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.367 -173.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.803 HD21 ' HG2' ' A' ' 73' ' ' GLN . 3.5 pp . . . . . 0 CA--C 1.53 0.196 0 CA-C-O 120.943 0.401 . . . . 0.0 110.963 -176.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.514 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 97.6 mmm . . . . . 0 N--CA 1.463 0.2 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.812 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 2.9 p -95.46 170.04 8.37 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.664 -0.207 . . . . 0.0 110.939 179.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.812 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 33.6 Cg_endo -61.9 -37.77 63.55 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.356 2.037 . . . . 0.0 114.252 -164.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -54.55 45.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.153 -174.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -76.46 -28.83 56.69 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.003 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.514 ' CD2' ' HB2' ' A' ' 67' ' ' MET . 12.1 mt -63.21 -19.81 64.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.653 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -71.75 -45.42 61.75 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.37 -23.93 67.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.71 172.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.486 ' O ' ' HB2' ' A' ' 79' ' ' MET . 27.3 t60 -66.94 -39.78 87.39 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.787 176.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.841 ' HE1' HD21 ' A' ' 145' ' ' LEU . 5.2 m-30 -69.21 -25.65 64.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.264 0.554 . . . . 0.0 110.024 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.672 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 44.3 t80 -75.39 -54.23 7.4 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.819 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.672 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.9 mmmt -81.03 -17.38 50.43 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.486 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -45.74 -25.75 0.54 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.103 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.816 ' HE1' HD23 ' A' ' 93' ' ' LEU . 0.2 OUTLIER -157.93 9.56 0.17 Allowed 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.003 -165.385 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.548 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 27.8 t70 -89.12 61.78 5.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.736 0.779 . . . . 0.0 109.627 -176.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.438 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 11.6 m-85 -76.44 -24.13 53.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.932 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -70.34 -14.49 62.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.998 -174.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 63.13 28.14 71.67 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.85 -0.614 . . . . 0.0 113.218 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -96.76 -2.78 43.62 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 117.465 0.633 . . . . 0.0 110.396 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 59.11 34.98 23.63 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.519 HD22 ' HB2' ' A' ' 135' ' ' TYR . 7.6 mt -150.9 155.87 40.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.403 177.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.605 ' HB2' HG22 ' A' ' 136' ' ' ILE . 2.3 mm? -114.48 112.04 22.35 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.567 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 12.7 t70 -82.9 161.98 21.7 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 173.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.5 ' HA2' ' HB2' ' A' ' 93' ' ' LEU . . . -54.93 -32.73 56.2 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.103 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.567 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 32.1 mt -59.73 -49.02 79.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.972 0.415 . . . . 0.0 110.31 178.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.548 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.6 mt-10 -63.28 -50.2 71.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.692 0.758 . . . . 0.0 109.15 173.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.816 HD23 ' HE1' ' A' ' 80' ' ' HIS . 46.2 mt -58.96 -15.11 11.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.548 -1.205 . . . . 0.0 113.432 -171.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.885 ' HA ' HD13 ' A' ' 121' ' ' ILE . 65.4 p -52.21 -33.68 42.19 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.294 0.371 . . . . 0.0 111.865 -178.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.39 -31.34 16.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.591 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -94.93 -33.51 12.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -170.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.815 HD12 HG21 ' A' ' 124' ' ' VAL . 31.1 mm -63.67 -18.08 21.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.28 0.562 . . . . 0.0 110.283 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.695 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 2.6 m -60.01 -14.85 18.21 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.683 172.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -115.81 -39.99 3.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.706 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.6 t -60.54 -53.59 46.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.984 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 64.3 t60 . . . . . 0 N--CA 1.451 -0.398 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 172.766 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 N--CA 1.443 -0.777 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . 0.695 ' HD2' ' O ' ' A' ' 98' ' ' THR . 39.2 Cg_endo -69.86 60.58 1.74 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.373 2.048 . . . . 0.0 111.665 172.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.49 77.53 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 121.931 0.872 . . . . 0.0 109.528 175.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.458 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.5 ptt? -83.52 -53.71 5.49 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.982 -1.463 . . . . 0.0 109.891 178.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 58.3 m -164.42 131.97 3.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 175.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.537 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.5 OUTLIER -61.85 -33.65 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.54 -173.695 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -70.51 -40.41 73.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 110.388 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -67.76 -37.72 82.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.653 HD21 HG23 ' A' ' 98' ' ' THR . 9.4 tp -62.02 -42.06 98.76 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.149 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.7 mt -56.71 -41.64 75.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.932 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -72.49 -33.82 67.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.722 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.02 -36.34 76.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 177.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.885 HD13 ' HA ' ' A' ' 94' ' ' SER . 86.5 mt -65.26 -44.4 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.016 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.753 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 35.0 t70 -63.2 -36.82 84.89 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.02 -32.0 59.2 Favored Glycine 0 C--N 1.332 0.334 0 N-CA-C 111.655 -0.578 . . . . 0.0 111.655 174.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.815 HG21 HD12 ' A' ' 97' ' ' ILE . 49.5 t -64.76 -49.16 81.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.883 0.373 . . . . 0.0 110.154 173.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.52 -10.62 36.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.295 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.753 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 29.2 mtm180 -99.09 -48.3 4.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.482 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -118.91 -37.25 3.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.547 ' HB2' HG13 ' A' ' 124' ' ' VAL . 17.5 m-20 -75.15 -19.64 59.77 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.02 0.438 . . . . 0.0 110.869 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.414 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 0.7 OUTLIER -79.45 94.23 5.52 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 167.281 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -79.47 -20.47 47.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.368 -172.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -82.68 -15.37 52.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.414 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 13.8 m120 62.64 37.96 12.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.277 -171.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -103.98 -5.6 22.05 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.36 -18.84 50.49 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.109 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.519 ' HB2' HD22 ' A' ' 87' ' ' LEU . 29.3 m-85 -115.74 166.31 12.09 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 116.983 0.392 . . . . 0.0 110.367 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.605 HG22 ' HB2' ' A' ' 88' ' ' LEU . 8.5 tt -103.4 121.93 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 CA-C-O 121.855 0.836 . . . . 0.0 109.727 176.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.79 172.13 7.25 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.492 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.866 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 19.1 t80 -51.08 -47.37 61.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.28 0.363 . . . . 0.0 110.969 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.5 71.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.373 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -81.34 -50.82 9.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.819 -171.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.866 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -70.22 -34.55 73.03 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.832 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.501 ' HA ' HD12 ' A' ' 145' ' ' LEU . . . -68.07 -31.56 71.28 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.006 0.432 . . . . 0.0 110.465 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -76.68 -27.9 55.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.04 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.0 t -78.5 -18.69 54.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.841 HD21 ' HE1' ' A' ' 76' ' ' TYR . 76.8 mt . . . . . 0 N--CA 1.452 -0.356 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.562 176.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.63 ' HB2' HD21 ' A' ' 72' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.369 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.549 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 50.6 m -84.05 157.46 62.89 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.959 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.38 -45.66 36.07 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.101 2.534 . . . . 0.0 114.283 -172.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -64.15 -43.59 94.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.821 -171.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.549 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 2.5 pm0 -77.06 -26.46 53.56 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.372 174.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.63 HD21 ' HB2' ' A' ' 67' ' ' MET . 13.2 mt -63.21 -21.53 66.28 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.511 ' HG2' HD21 ' A' ' 145' ' ' LEU . 24.6 mt-30 -68.89 -44.99 72.09 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.49 -19.05 65.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.583 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.557 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 45.0 t60 -69.55 -34.15 73.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.373 -0.376 . . . . 0.0 109.992 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.706 ' CD2' HG22 ' A' ' 100' ' ' VAL . 5.1 m-30 -72.06 -27.83 62.94 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.568 ' O ' HD11 ' A' ' 88' ' ' LEU . 34.6 t80 -73.69 -52.66 12.52 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.738 176.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.55 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.28 -13.03 59.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -175.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.461 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 2.2 tpt -45.57 -38.26 6.29 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.173 0.589 . . . . 0.0 112.285 -173.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.413 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -143.04 11.14 1.77 Allowed 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.041 -178.495 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.745 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 35.1 t70 -79.74 84.33 5.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.648 0.737 . . . . 0.0 110.557 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -119.02 22.59 11.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.183 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.7 p30 -110.86 -14.11 14.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.769 -174.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 68.79 25.9 74.9 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.079 -0.51 . . . . 0.0 113.107 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -101.03 -1.95 32.92 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 117.46 0.63 . . . . 0.0 111.371 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 63.21 27.33 15.53 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.172 176.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.608 HD22 ' HB2' ' A' ' 135' ' ' TYR . 15.5 mt -153.27 167.61 28.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.461 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.568 HD11 ' O ' ' A' ' 77' ' ' PHE . 3.0 mm? -124.39 121.81 35.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.356 -179.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.568 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.2 p-10 -104.52 -179.25 3.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.83 -36.79 33.91 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 114.201 0.44 . . . . 0.0 114.201 -177.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.568 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 30.8 mt -64.3 -53.44 48.8 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.321 0.582 . . . . 0.0 110.552 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.745 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 41.6 mt-10 -62.95 -47.98 80.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.916 178.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.818 ' HB3' HG12 ' A' ' 97' ' ' ILE . 37.9 mt -66.23 -10.68 44.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.98 -174.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.974 ' HA ' HD13 ' A' ' 121' ' ' ILE . 24.0 t -56.4 -34.52 66.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.734 0.302 . . . . 0.0 110.845 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.9 m -92.22 -28.57 16.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.239 0.542 . . . . 0.0 111.569 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.538 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -83.72 -47.13 11.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.739 -171.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.892 HD12 HG21 ' A' ' 124' ' ' VAL . 33.8 mm -60.14 -20.84 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.383 -175.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.827 HG22 ' HB1' ' A' ' 109' ' ' ALA . 8.9 m -51.02 -30.55 15.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.971 174.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.472 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 68.5 m-70 -103.82 -33.07 9.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.687 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.706 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.5 t -68.06 -51.74 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.478 -173.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 29.9 t60 . . . . . 0 C--O 1.234 0.242 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.847 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.827 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.508 -0.654 0 CA-C-O 120.429 0.157 . . . . 0.0 110.978 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.11 63.3 8.21 Favored 'Trans proline' 0 N--CA 1.445 -1.36 0 C-N-CA 121.886 1.724 . . . . 0.0 111.05 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.4 89.63 0.01 OUTLIER 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.837 0.827 . . . . 0.0 111.402 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.431 ' HG3' ' H ' ' A' ' 113' ' ' SER . 13.2 ptt? -93.48 -59.06 2.1 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.001 178.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.431 ' H ' ' HG3' ' A' ' 112' ' ' MET . 74.9 m -164.63 123.93 1.88 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 178.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.625 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.1 OUTLIER -54.04 -34.97 61.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.87 -174.788 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.465 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 21.2 t70 -71.36 -42.68 68.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.948 0.404 . . . . 0.0 110.666 -178.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.02 -38.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.859 0.838 . . . . 0.0 108.93 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.679 HD21 HG23 ' A' ' 98' ' ' THR . 9.5 tp -61.25 -37.1 81.88 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.333 177.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.625 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.0 mt -57.13 -43.7 81.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.474 175.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -65.49 -39.29 91.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.464 0.65 . . . . 0.0 109.607 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -61.46 -41.44 90.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.008 -0.996 . . . . 0.0 111.171 178.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.974 HD13 ' HA ' ' A' ' 94' ' ' SER . 90.1 mt -65.26 -38.58 82.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.953 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.796 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.8 t70 -63.7 -42.14 98.02 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.35 -32.0 57.25 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.368 176.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.892 HG21 HD12 ' A' ' 97' ' ' ILE . 46.5 t -61.82 -47.88 91.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.949 0.404 . . . . 0.0 110.215 174.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 66.3 mt -67.61 -7.45 26.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.82 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.796 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 22.5 mtp85 -103.48 -47.21 4.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.744 -178.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -112.7 -48.83 2.98 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.6 ' HB2' HG13 ' A' ' 124' ' ' VAL . 20.9 m-20 -68.84 -22.37 64.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.123 -174.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.595 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 6.1 t70 -76.35 80.3 3.1 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.55 -17.96 63.61 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 114.649 -1.159 . . . . 0.0 111.844 -169.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -116.85 10.23 14.1 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.928 -172.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.595 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 17.9 m120 53.63 44.63 29.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.579 173.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -99.13 -13.09 19.94 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.199 176.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.02 4.17 78.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.128 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.608 ' HB2' HD22 ' A' ' 87' ' ' LEU . 34.4 m-85 -133.65 176.68 8.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.427 HG23 ' HD1' ' A' ' 141' ' ' PHE . 8.3 tt -117.6 119.62 62.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.359 0.6 . . . . 0.0 109.73 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -97.53 -178.67 4.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.823 177.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.763 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.5 t80 -56.03 -47.92 76.93 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 123.44 0.463 . . . . 0.0 111.058 -173.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.99 66.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.959 0.409 . . . . 0.0 111.548 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.575 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 50.9 mt-10 -74.27 -53.87 8.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.849 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.763 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.8 p90 -72.84 -28.83 62.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.876 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.39 81.48 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 110.393 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -73.91 -32.16 63.42 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.025 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . 0.453 ' HB3' HG12 ' A' ' 100' ' ' VAL . 9.0 t -81.3 -38.81 26.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.039 -171.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.511 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.3 pp . . . . . 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.646 -175.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.526 ' HB2' HD21 ' A' ' 72' ' ' LEU . 95.9 mmm . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.664 0.269 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.446 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 9.0 m -82.4 157.74 67.32 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.428 -178.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.551 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 75.0 Cg_exo -50.76 -48.94 18.43 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.902 2.401 . . . . 0.0 114.255 -173.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -59.92 -49.5 77.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.446 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 5.3 pm0 -71.7 -28.92 64.03 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.737 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.526 HD21 ' HB2' ' A' ' 67' ' ' MET . 11.3 mt -64.27 -21.28 66.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.371 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 24.1 mt-30 -69.57 -46.31 66.68 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 49.1 tp -65.15 -20.91 66.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.896 173.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 48.8 t60 -69.67 -43.3 72.81 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 76' ' ' TYR . 4.2 m-30 -65.69 -25.16 67.19 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.618 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 45.1 t80 -75.6 -53.56 8.4 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.039 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.618 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.3 mmmt -79.9 -30.88 40.22 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -173.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 17.3 tpp -47.93 -36.29 12.14 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -170.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.832 ' HE1' HD23 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -135.2 8.37 3.43 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -169.015 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.667 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.0 t70 -88.51 73.03 8.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.016 0.913 . . . . 0.0 109.354 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -72.08 -22.37 61.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.313 -175.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -87.06 -15.89 37.24 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.533 -175.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.418 ' HA2' ' OD1' ' A' ' 81' ' ' ASP . . . 62.58 29.69 74.35 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 115.545 -0.752 . . . . 0.0 114.401 175.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -94.19 6.87 47.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 117.783 0.791 . . . . 0.0 111.464 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 69.79 13.65 8.06 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.839 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.546 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.2 mm? -131.16 152.44 50.44 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.09 0.472 . . . . 0.0 110.309 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.681 HD22 ' CD2' ' A' ' 80' ' ' HIS . 14.5 mt -119.94 109.16 15.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.612 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.618 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 11.1 t70 -75.3 160.93 29.76 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . 0.502 ' HA2' ' HB2' ' A' ' 93' ' ' LEU . . . -53.4 -29.5 38.64 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 121.29 -0.481 . . . . 0.0 112.386 174.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.618 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.8 mt -60.35 -55.26 35.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 110.085 175.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.667 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 34.7 mt-10 -59.37 -53.02 62.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.207 174.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.832 HD23 ' HE1' ' A' ' 80' ' ' HIS . 69.1 mt -55.59 -17.07 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.897 -172.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.902 ' HA ' HD13 ' A' ' 121' ' ' ILE . 15.8 t -52.48 -32.01 37.83 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.362 0.414 . . . . 0.0 111.912 -177.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -29.4 17.43 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.533 ' HB3' ' CE1' ' A' ' 80' ' ' HIS . . . -98.13 -28.07 13.9 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -168.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.723 ' CG1' ' HB3' ' A' ' 93' ' ' LEU . 34.5 mm -66.52 -17.08 21.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.671 0.748 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.812 HG23 HD21 ' A' ' 117' ' ' LEU . 5.6 m -63.22 -17.2 62.18 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.735 172.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.58 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 98.9 m-70 -112.46 -21.41 11.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.074 0.464 . . . . 0.0 110.088 174.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.691 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.1 t -77.76 -59.39 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.149 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . 0.54 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.4 t60 . . . . . 0 C--O 1.234 0.24 0 CA-C-O 121.399 0.619 . . . . 0.0 109.811 -179.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.58 ' HB2' ' CE1' ' A' ' 99' ' ' HIS . . . . . . . . 0 CA--C 1.504 -0.815 0 CA-C-O 120.604 0.24 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 1.1 Cg_endo -83.34 68.73 7.14 Favored 'Trans proline' 0 N--CA 1.432 -2.089 0 C-N-CA 121.708 1.605 . . . . 0.0 111.287 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.07 74.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.049 0.928 . . . . 0.0 110.28 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.484 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.3 ptt? -90.88 -50.75 5.71 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.597 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -159.4 125.45 4.37 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.537 ' O ' HG13 ' A' ' 118' ' ' ILE . 11.5 pt-20 -57.14 -41.88 79.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.391 -176.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -66.34 -50.28 64.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.979 0.418 . . . . 0.0 110.286 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.05 -41.32 78.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.245 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.812 HD21 HG23 ' A' ' 98' ' ' THR . 9.0 tp -63.76 -36.95 85.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 114' ' ' GLU . 87.6 mt -60.57 -44.0 95.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.231 174.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -66.47 -32.26 73.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.047 0.451 . . . . 0.0 110.459 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.54 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.64 -39.01 78.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.572 174.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.902 HD13 ' HA ' ' A' ' 94' ' ' SER . 46.3 mt -74.98 -19.26 16.35 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 CA-C-O 121.191 0.519 . . . . 0.0 110.591 177.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.687 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 30.2 t70 -74.11 -41.08 62.18 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.6 -35.92 63.31 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 114.588 -1.187 . . . . 0.0 113.211 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.836 HG13 HD12 ' A' ' 125' ' ' LEU . 7.2 p -62.56 -47.17 94.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 CA-C-N 117.529 0.664 . . . . 0.0 110.533 178.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.836 HD12 HG13 ' A' ' 124' ' ' VAL . 5.4 mp -70.44 -11.81 61.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.847 0.356 . . . . 0.0 111.379 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.687 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 20.2 mtm180 -92.92 -49.28 6.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -125.8 -26.8 3.43 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.67 ' HB2' HG23 ' A' ' 124' ' ' VAL . 41.8 m-20 -79.14 -28.47 42.83 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.685 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.5 96.41 3.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.578 0.704 . . . . 0.0 109.367 171.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -80.85 -18.75 46.36 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.768 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -78.58 -15.76 58.19 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.062 0.458 . . . . 0.0 110.16 -176.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 66.0 t30 59.67 33.28 21.88 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.601 -173.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -97.88 -16.8 19.6 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.275 -178.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.69 -34.62 5.46 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.687 178.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.546 ' HB2' HD12 ' A' ' 87' ' ' LEU . 6.9 m-85 -114.73 168.84 9.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.46 0.63 . . . . 0.0 111.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.668 HG22 HD12 ' A' ' 88' ' ' LEU . 0.2 OUTLIER -95.59 127.48 47.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.333 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -176.44 3.08 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.255 169.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.797 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.3 t80 -55.4 -48.09 74.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.569 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.22 -27.35 68.61 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.502 ' OE2' ' HA ' ' A' ' 136' ' ' ILE . 56.6 mt-10 -81.66 -47.93 12.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.79 -173.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.797 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.1 p90 -71.13 -30.44 66.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.494 176.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.27 86.47 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.514 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.46 -29.15 52.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.618 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 22.7 t -80.11 -33.94 38.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.398 -172.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.5 pp . . . . . 0 N--CA 1.465 0.283 0 CA-C-O 120.842 0.353 . . . . 0.0 111.41 -178.872 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.767 ' HB2' HD11 ' A' ' 72' ' ' LEU . 93.0 mmm . . . . . 0 C--O 1.232 0.149 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.425 ' O ' HD13 ' A' ' 72' ' ' LEU . 16.2 m -83.32 155.52 66.46 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.41 -41.36 43.63 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 123.022 2.481 . . . . 0.0 114.152 -172.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 73' ' ' GLN . 12.2 pt20 -57.56 -39.67 77.2 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.039 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.415 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 4.4 mm-40 -67.72 -44.83 76.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.84 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 10.0 mp -61.29 -21.85 64.32 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.075 -168.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.41 ' NE2' ' HA ' ' A' ' 70' ' ' GLN . 18.5 mt-30 -62.85 -49.68 73.91 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HG ' ' HG2' ' A' ' 78' ' ' LYS . 28.1 tp -68.03 -24.31 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.911 174.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.84 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.4 t60 -67.07 -41.54 86.25 Favored 'General case' 0 C--O 1.225 -0.198 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.733 ' CD1' HG22 ' A' ' 100' ' ' VAL . 4.4 m-30 -72.4 -38.04 68.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.634 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.621 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 51.8 t80 -63.66 -51.55 64.62 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.69 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.614 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 23.7 mmmt -79.01 -19.12 52.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.2 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 16.8 tpp -44.16 -50.44 8.67 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.954 0.784 . . . . 0.0 112.203 -173.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -130.0 9.97 5.39 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.414 -0.515 . . . . 0.0 111.549 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.699 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.3 t70 -82.46 72.19 9.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.689 0.757 . . . . 0.0 110.09 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.1 13.58 30.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.059 178.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.1 p30 -101.65 -13.71 17.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.835 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 65.18 32.0 82.48 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.561 -0.745 . . . . 0.0 113.3 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -107.52 -4.54 18.3 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.597 0.698 . . . . 0.0 111.763 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.1 m120 68.37 12.31 8.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.027 0.531 . . . . 0.0 112.255 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.564 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -128.54 164.71 22.22 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.562 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 65.7 mt -126.32 119.26 26.9 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.235 174.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.49 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.3 p30 -99.0 -176.72 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 175.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.21 -36.6 52.86 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.758 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.49 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 46.4 mt -63.52 -47.24 82.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.178 0.513 . . . . 0.0 110.29 -177.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.699 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 36.6 mt-10 -69.12 -49.95 52.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.742 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.797 ' HB3' HG12 ' A' ' 97' ' ' ILE . 35.1 mt -63.94 -14.7 55.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.263 -173.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.779 ' HA ' HD13 ' A' ' 121' ' ' ILE . 79.7 p -56.51 -37.54 70.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.859 0.361 . . . . 0.0 111.008 -178.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -91.71 -27.15 18.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.348 0.594 . . . . 0.0 111.141 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.627 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -82.27 -48.51 11.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.605 -172.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.933 HG21 ' HA ' ' A' ' 121' ' ' ILE . 30.4 mm -59.66 -25.75 32.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.954 -174.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.694 HG23 HD21 ' A' ' 117' ' ' LEU . 20.9 m -55.94 -22.23 25.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.132 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.522 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 90.4 m-70 -110.8 -11.43 14.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.499 177.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.733 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.7 t -95.1 -49.42 12.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -175.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . 0.575 ' CD2' HG13 ' A' ' 120' ' ' ILE . 69.8 t60 . . . . . 0 C--N 1.33 -0.274 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.308 -174.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.658 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.503 -0.849 0 CA-C-O 120.875 0.369 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -84.03 68.95 6.58 Favored 'Trans proline' 0 N--CA 1.431 -2.153 0 C-N-CA 121.288 1.326 . . . . 0.0 111.241 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.63 80.23 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 122.115 0.96 . . . . 0.0 110.782 172.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.483 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.1 ptt? -92.86 -58.03 2.46 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.315 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.9 m -159.68 122.11 3.43 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.609 ' O ' HG13 ' A' ' 118' ' ' ILE . 5.0 pm0 -56.44 -34.16 66.56 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -74.08 -35.23 64.22 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.204 -0.598 . . . . 0.0 110.135 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -68.63 -39.21 80.87 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.694 HD21 HG23 ' A' ' 98' ' ' THR . 11.6 tp -59.92 -39.02 84.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.296 177.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.609 HG13 ' O ' ' A' ' 114' ' ' GLU . 95.9 mt -61.22 -44.86 99.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.742 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -65.65 -32.88 74.7 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 109.987 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.575 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.49 -38.68 76.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.537 175.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.933 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -68.42 -39.6 81.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.411 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.731 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.5 t70 -61.99 -44.85 95.86 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.11 -34.4 52.76 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.466 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.813 HG21 HD12 ' A' ' 97' ' ' ILE . 47.3 t -65.04 -48.35 84.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.86 0.362 . . . . 0.0 110.414 175.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.447 HD22 ' O ' ' A' ' 134' ' ' GLY . 88.1 mt -67.87 -4.88 14.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.08 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.731 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.4 mtm180 -103.29 -49.21 3.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -120.21 -35.41 3.45 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.656 ' HB2' HG13 ' A' ' 124' ' ' VAL . 26.3 m-20 -78.23 -16.7 57.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.153 0.501 . . . . 0.0 110.288 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.74 90.85 3.44 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -17.04 59.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.731 -167.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -119.94 17.95 12.52 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 54.71 40.23 31.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.442 172.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 p30 -102.53 -11.49 18.49 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.261 177.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.447 ' O ' HD22 ' A' ' 125' ' ' LEU . . . 84.16 1.15 89.63 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.617 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.564 ' HB2' HD12 ' A' ' 87' ' ' LEU . 13.8 m-85 -127.59 178.86 5.83 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.535 HG22 HD21 ' A' ' 93' ' ' LEU . 3.7 tt -121.41 125.53 73.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -103.14 -177.62 3.43 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.104 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.888 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 15.2 t80 -56.66 -48.82 76.76 Favored 'General case' 0 C--O 1.227 -0.128 0 O-C-N 123.3 0.375 . . . . 0.0 110.838 -175.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.19 -21.91 64.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.694 0.283 . . . . 0.0 111.558 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -78.52 -56.78 4.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.888 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -67.63 -32.08 72.54 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.855 -0.738 . . . . 0.0 110.097 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.61 -39.95 78.04 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.953 0.406 . . . . 0.0 110.421 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.3 mtmm -75.34 -28.11 59.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.961 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.2 t -79.21 -19.01 51.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.82 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 68.3 mt . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.415 178.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.493 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 98.9 mmm . . . . . 0 N--CA 1.464 0.24 0 CA-C-O 121.142 0.496 . . . . 0.0 111.732 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.545 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 17.2 m -93.16 163.41 25.24 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.742 -178.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.578 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.6 Cg_exo -53.34 -49.92 15.76 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.809 2.339 . . . . 0.0 113.969 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.53 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 2.1 pt20 -61.77 -49.94 74.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.068 -176.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 68' ' ' SER . 0.8 OUTLIER -61.27 -43.34 99.03 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.675 175.077 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.55 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 12.3 mt -62.44 -22.85 66.52 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.702 -173.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.838 ' HG2' HD21 ' A' ' 145' ' ' LEU . 21.1 mt-30 -71.3 -39.67 71.32 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 175.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.51 -24.67 65.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.384 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.55 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 59.3 t60 -65.88 -46.43 78.43 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 175.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.458 ' CD1' HD22 ' A' ' 145' ' ' LEU . 3.3 m-30 -63.69 -33.65 76.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.189 0.519 . . . . 0.0 109.64 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.548 ' HA ' HD11 ' A' ' 88' ' ' LEU . 65.2 t80 -65.62 -51.91 56.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.204 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.454 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 27.4 mmmt -79.69 -15.5 57.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.547 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.4 tpt -45.2 -44.29 10.84 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.597 0.759 . . . . 0.0 112.519 -170.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.551 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -137.41 10.29 2.96 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.706 -177.569 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.714 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.1 t70 -83.2 88.69 6.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.243 0.544 . . . . 0.0 110.21 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.453 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 26.7 m-85 -110.46 -0.91 17.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.149 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -87.64 -14.68 39.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.582 -174.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.97 78.0 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 121.162 -0.542 . . . . 0.0 113.425 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -95.41 -5.4 43.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 117.706 0.753 . . . . 0.0 111.311 -177.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 64.84 18.25 11.38 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.177 0.591 . . . . 0.0 112.033 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.591 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -130.4 167.76 18.06 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 172.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.548 HD11 ' HA ' ' A' ' 77' ' ' PHE . 68.1 mt -131.04 117.28 18.93 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.813 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -93.76 -178.93 4.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.143 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -56.68 -33.89 63.64 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.128 -0.558 . . . . 0.0 113.331 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 19.9 mt -69.55 -48.38 60.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.176 0.512 . . . . 0.0 109.932 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.714 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 45.6 mt-10 -62.99 -49.24 75.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.886 0.85 . . . . 0.0 109.39 174.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.805 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.2 mt -66.57 -9.84 39.31 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.924 -1.034 . . . . 0.0 113.407 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 1.03 ' HA ' HD13 ' A' ' 121' ' ' ILE . 34.6 t -54.57 -31.64 57.03 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.024 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.05 -36.75 13.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 0.0 111.339 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.49 -39.26 22.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.845 -168.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.805 HG12 ' HB3' ' A' ' 93' ' ' LEU . 39.1 mm -67.87 -16.33 20.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.959 0.409 . . . . 0.0 111.16 -176.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.568 HG23 HD21 ' A' ' 117' ' ' LEU . 8.7 m -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.471 175.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 64.3 m-70 -102.86 -23.72 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.275 174.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.761 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 73.4 t -77.97 -63.8 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.729 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . 0.486 ' CD2' HG13 ' A' ' 120' ' ' ILE . 13.3 t60 . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 121.249 0.547 . . . . 0.0 110.324 -176.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.53 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.507 -0.688 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -89.41 67.72 2.31 Favored 'Trans proline' 0 N--CA 1.432 -2.132 0 C-N-CA 122.015 1.81 . . . . 0.0 111.177 175.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 52.7 tp -59.0 84.25 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.792 0.806 . . . . 0.0 110.781 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.438 ' H ' ' HG2' ' A' ' 112' ' ' MET . 15.5 ptt? -81.96 -55.95 4.27 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.86 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.9 m -162.09 118.72 2.06 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.564 ' O ' HG13 ' A' ' 118' ' ' ILE . 2.5 pm0 -57.47 -34.82 69.41 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -173.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 16.7 t70 -69.9 -42.6 73.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 109.946 -178.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.32 -37.26 80.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.292 175.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.568 HD21 HG23 ' A' ' 98' ' ' THR . 11.7 tp -61.89 -36.45 81.32 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.956 177.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 114' ' ' GLU . 61.8 mt -57.7 -47.4 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.436 174.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -67.14 -27.01 66.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 176.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.496 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -69.66 -38.49 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.695 175.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 1.03 HD13 ' HA ' ' A' ' 94' ' ' SER . 76.1 mt -74.78 -18.29 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.536 0.684 . . . . 0.0 109.806 176.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.665 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 4.5 m-20 -75.35 -42.41 54.27 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 166.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.4 -38.26 68.83 Favored Glycine 0 C--O 1.227 -0.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.037 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.769 HG23 ' HB2' ' A' ' 128' ' ' ASP . 7.5 p -59.34 -49.19 84.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 117.468 0.634 . . . . 0.0 109.765 176.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.5 mt -69.89 -8.39 48.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.221 0.534 . . . . 0.0 111.269 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.665 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 39.7 mmt-85 -100.56 -31.91 11.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.499 -179.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.36 -48.9 0.78 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.769 ' HB2' HG23 ' A' ' 124' ' ' VAL . 32.8 m-20 -65.96 -25.99 67.36 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.492 0.663 . . . . 0.0 110.137 -177.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.831 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -72.42 90.8 1.32 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.924 -1.034 . . . . 0.0 108.735 168.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.84 -29.8 50.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.523 -169.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -90.86 -6.05 54.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.333 0.587 . . . . 0.0 111.024 -177.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.831 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 9.5 m120 55.95 49.46 15.8 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.353 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 p30 -95.22 -8.1 37.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.199 175.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 -1.3 85.49 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.45 177.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.591 ' HB2' HD12 ' A' ' 87' ' ' LEU . 24.1 m-85 -131.42 176.03 8.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 109.983 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.529 HD12 ' CG2' ' A' ' 124' ' ' VAL . 10.1 tt -112.09 118.7 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.796 0.808 . . . . 0.0 110.507 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -93.58 170.65 9.43 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.583 177.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.864 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.2 t80 -46.62 -54.94 8.46 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.061 0.544 . . . . 0.0 111.224 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.19 -25.88 68.54 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.021 0.439 . . . . 0.0 111.839 -176.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.535 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -77.81 -52.76 8.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.937 -175.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.864 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -72.64 -31.07 64.83 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.644 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.76 -40.54 79.98 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.889 0.376 . . . . 0.0 110.791 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -76.94 -29.25 55.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.333 177.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . 0.412 ' HB3' HG13 ' A' ' 100' ' ' VAL . 22.7 t -82.8 -38.15 23.51 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.025 -170.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.838 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.662 -173.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.644 ' HB2' HD21 ' A' ' 72' ' ' LEU . 88.6 mmm . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.9 p -116.22 159.65 38.85 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 121.348 -0.141 . . . . 0.0 111.168 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.509 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 82.6 Cg_exo -49.33 -39.79 43.66 Favored 'Trans proline' 0 N--CA 1.481 0.741 0 C-N-CA 123.608 2.872 . . . . 0.0 115.511 -169.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.474 ' HA ' HE21 ' A' ' 73' ' ' GLN . 0.0 OUTLIER -57.56 -54.79 42.89 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 121.227 0.537 . . . . 0.0 110.648 -175.543 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -76.99 -27.17 54.62 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.886 177.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.644 HD21 ' HB2' ' A' ' 67' ' ' MET . 14.0 mt -65.57 -17.56 64.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 120.875 0.369 . . . . 0.0 111.502 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.54 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 44.4 mt-30 -71.23 -47.93 54.28 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 171.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.5 -22.49 63.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.016 172.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.555 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 68.7 t60 -67.15 -37.07 83.15 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.329 176.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.539 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 3.8 m-30 -70.34 -34.62 72.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.483 0.659 . . . . 0.0 109.394 177.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.692 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 55.5 t80 -67.78 -52.3 38.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.913 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.692 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.2 mmmt -79.34 -14.81 58.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.381 -175.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.483 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.0 OUTLIER -45.33 -38.11 5.46 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 124.052 0.845 . . . . 0.0 111.816 -174.401 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.459 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -142.81 9.52 1.75 Allowed 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.713 178.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.502 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.7 t70 -85.21 79.51 9.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.863 0.84 . . . . 0.0 109.829 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 -11.22 24.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.7 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -90.14 -14.71 33.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.526 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.88 24.57 66.82 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.328 -0.851 . . . . 0.0 114.92 171.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -87.67 5.23 40.7 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.545 1.172 . . . . 0.0 111.012 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.542 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 11.3 m120 70.3 5.74 5.47 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.678 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.556 HD12 ' HB2' ' A' ' 135' ' ' TYR . 3.7 mm? -121.22 145.56 47.72 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.296 0.57 . . . . 0.0 109.932 175.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.487 ' HB3' ' HG ' ' A' ' 93' ' ' LEU . 3.6 mm? -107.44 110.71 22.73 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.149 174.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.588 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.4 p30 -84.64 -174.1 5.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.189 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.08 -47.43 66.94 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.093 0.397 . . . . 0.0 114.093 -176.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.658 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.8 pp -77.14 -28.16 54.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.599 0.699 . . . . 0.0 110.641 -175.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.658 ' N ' HD12 ' A' ' 91' ' ' LEU . 45.5 mt-10 -65.98 -55.08 18.57 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 172.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.939 ' HB3' HG12 ' A' ' 97' ' ' ILE . 32.7 mt -64.21 -12.58 42.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.198 -178.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.719 ' HA ' HD13 ' A' ' 121' ' ' ILE . 39.4 m -55.12 -34.13 63.45 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.595 0.236 . . . . 0.0 111.617 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -92.81 -31.49 15.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.19 0.519 . . . . 0.0 111.225 174.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.456 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . . . -80.04 -42.31 24.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.222 -170.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.939 HG12 ' HB3' ' A' ' 93' ' ' LEU . 41.2 mm -62.7 -25.2 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 111.055 -176.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.624 HG22 ' HB1' ' A' ' 109' ' ' ALA . 2.7 m -58.69 -18.61 32.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.58 176.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 72.9 m-70 -115.51 -33.47 5.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.369 172.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.873 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 39.1 t -58.91 -55.46 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 40.2 t60 . . . . . 0 C--O 1.234 0.247 0 CA-C-O 121.436 0.636 . . . . 0.0 110.348 -177.617 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.624 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.507 -0.698 0 N-CA-C 110.491 -0.189 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -74.48 61.38 5.2 Favored 'Trans proline' 0 N--CA 1.448 -1.203 0 C-N-CA 121.904 1.736 . . . . 0.0 110.848 172.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.8 tp -71.67 74.54 0.82 Allowed 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 122.185 0.993 . . . . 0.0 110.578 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.472 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.0 ptt? -75.61 -53.61 8.31 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.268 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.0 m -159.86 122.9 3.52 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 175.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.57 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -61.09 -33.97 74.2 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -170.179 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.61 -40.71 76.46 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.215 0.531 . . . . 0.0 110.37 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.0 tt0 -68.85 -36.69 78.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.848 0.832 . . . . 0.0 109.56 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.49 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.4 tm? -63.94 -36.81 85.17 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.612 177.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.57 HG13 ' O ' ' A' ' 114' ' ' GLU . 70.1 mt -62.52 -38.95 82.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.669 174.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -64.5 -40.45 95.67 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 174.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.64 -39.35 79.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.595 175.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.878 ' HA ' HG21 ' A' ' 97' ' ' ILE . 76.0 mt -59.85 -47.91 89.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.284 175.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.782 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 34.7 t70 -61.49 -39.89 92.58 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.66 -31.21 52.97 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.873 175.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.847 HG21 HD12 ' A' ' 97' ' ' ILE . 42.9 t -68.25 -49.22 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.291 -0.262 . . . . 0.0 110.291 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 134' ' ' GLY . 8.8 mp -63.63 -10.34 18.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.018 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.782 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 24.2 mtm-85 -102.31 -49.24 3.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -113.45 -45.1 3.15 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -172.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.609 ' HB2' HG13 ' A' ' 124' ' ' VAL . 10.1 m-20 -68.91 -24.09 64.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.898 0.38 . . . . 0.0 110.682 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.564 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.9 t70 -74.68 93.52 2.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.88 0.847 . . . . 0.0 108.962 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -79.08 -18.88 52.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.167 -172.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -2.35 43.9 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.202 -171.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.3 t30 60.64 32.91 20.4 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.389 -177.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -99.0 -1.98 38.45 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 121.061 0.458 . . . . 0.0 110.067 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.451 ' O ' ' HG ' ' A' ' 125' ' ' LEU . . . 82.02 -24.42 4.65 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.735 -0.666 . . . . 0.0 113.35 173.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.556 ' HB2' HD12 ' A' ' 87' ' ' LEU . 18.5 m-85 -116.48 -179.19 3.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.932 0.396 . . . . 0.0 110.59 -176.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.714 HG12 ' HG3' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -110.82 129.73 65.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.388 0.613 . . . . 0.0 112.091 179.206 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.474 ' H ' ' HG2' ' A' ' 140' ' ' GLU . 12.2 t70 -103.11 168.09 9.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.473 172.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.876 ' HA ' ' CE2' ' A' ' 141' ' ' PHE . 21.5 t80 -50.86 -44.05 59.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.718 0.294 . . . . 0.0 110.834 -177.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.443 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -67.81 -31.31 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -173.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.714 ' HG3' HG12 ' A' ' 136' ' ' ILE . 12.7 pt-20 -91.19 -30.06 16.88 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.508 -169.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.876 ' CE2' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -76.11 -32.06 58.99 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.21 171.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.405 ' N ' ' CD1' ' A' ' 141' ' ' PHE . . . -64.13 -43.02 96.57 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.407 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.0 mtmt -72.77 -28.78 62.81 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.351 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.3 t -70.04 -35.15 74.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.943 0.401 . . . . 0.0 110.274 -177.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.448 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.3 pp . . . . . 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.475 -177.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.823 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.2 mmm . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.718 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 26.6 m -98.4 139.4 21.15 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-O 120.997 0.427 . . . . 0.0 110.625 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.768 ' HA ' ' HB2' ' A' ' 72' ' ' LEU . 73.3 Cg_exo -50.92 -27.97 22.49 Favored 'Trans proline' 0 N--CA 1.477 0.51 0 C-N-CA 124.085 3.19 . . . . 0.0 115.15 -172.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -65.06 -51.32 62.18 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-O 120.731 0.301 . . . . 0.0 111.017 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.718 ' HG2' ' O ' ' A' ' 68' ' ' SER . 3.0 pm0 -72.33 -26.36 61.9 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.09 173.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.823 HD21 ' HB2' ' A' ' 67' ' ' MET . 39.5 mt -66.82 -17.5 64.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.688 0.28 . . . . 0.0 111.627 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 42.4 mt-30 -73.08 -40.97 64.58 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 171.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.2 tp -66.88 -21.88 65.99 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 171.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.582 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 5.0 t60 -66.91 -35.0 79.01 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.103 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.43 ' HD1' HG22 ' A' ' 100' ' ' VAL . 4.0 m-30 -72.1 -33.58 67.97 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.552 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 54.3 t80 -67.09 -53.08 34.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.154 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.552 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.9 mmmt -80.53 -11.12 59.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.596 -176.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.427 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 3.5 tpt -43.12 -43.41 4.47 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.069 0.856 . . . . 0.0 112.005 -172.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.539 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -141.06 10.06 2.14 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.88 179.332 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.745 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 34.2 t70 -82.07 80.7 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.31 0.576 . . . . 0.0 110.854 -176.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.539 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 3.9 m-85 -108.32 -6.11 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.738 178.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.5 p30 -75.8 -13.68 60.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.734 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.67 23.66 72.13 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 116.025 -0.534 . . . . 0.0 113.464 175.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -108.41 -8.65 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.616 0.708 . . . . 0.0 110.964 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.444 ' HB3' ' HZ ' ' A' ' 77' ' ' PHE . 13.1 m120 64.41 20.58 12.21 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.564 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.49 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.9 mm? -127.89 157.04 41.6 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.609 ' HB2' HG22 ' A' ' 136' ' ' ILE . 83.2 mt -113.2 110.82 21.03 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.045 0.45 . . . . 0.0 111.537 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.524 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 8.0 t70 -83.31 161.45 21.42 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.565 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -44.59 -56.14 5.77 Favored Glycine 0 N--CA 1.464 0.514 0 N-CA-C 114.909 0.723 . . . . 0.0 114.909 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -73.55 -30.99 63.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.644 0.722 . . . . 0.0 111.262 -174.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.745 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.7 tt0 -69.61 -58.62 3.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.292 1.044 . . . . 0.0 108.768 176.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.951 ' HG ' HG12 ' A' ' 97' ' ' ILE . 40.7 tp -61.92 -10.44 9.5 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.755 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.849 ' HA ' HD13 ' A' ' 121' ' ' ILE . 18.8 m -51.94 -32.37 32.76 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.143 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.1 m -85.76 -27.34 25.28 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.531 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.826 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -85.17 -37.89 19.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -172.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.951 HG12 ' HG ' ' A' ' 93' ' ' LEU . 46.1 mm -64.3 -21.76 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 CA-C-O 120.902 0.382 . . . . 0.0 111.037 -177.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.647 HG22 ' HB1' ' A' ' 109' ' ' ALA . 4.2 m -57.58 -31.09 65.81 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.972 174.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.552 ' ND1' ' HB2' ' A' ' 109' ' ' ALA . 98.7 m-70 -101.42 -32.97 10.18 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.555 176.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.828 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 36.7 t -56.89 -52.42 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.486 0.184 . . . . 0.0 110.875 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 . . . . . 0 C--O 1.232 0.183 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.216 171.83 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.647 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.502 -0.878 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -83.04 67.1 7.79 Favored 'Trans proline' 0 N--CA 1.436 -1.862 0 C-N-CA 121.555 1.503 . . . . 0.0 111.305 175.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.22 79.61 0.05 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.368 1.08 . . . . 0.0 109.852 173.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.447 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.0 ptt? -92.15 -58.35 2.42 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 113.631 -1.622 . . . . 0.0 110.436 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.6 m -161.02 120.95 2.68 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.49 ' O ' HG13 ' A' ' 118' ' ' ILE . 9.2 pt-20 -56.39 -27.03 55.11 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -174.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.84 -47.18 78.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.375 0.607 . . . . 0.0 110.12 176.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.19 -38.8 85.97 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -60.65 -38.69 85.69 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.355 178.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 114' ' ' GLU . 30.9 mt -59.39 -50.62 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.517 174.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.2 -33.01 74.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.132 0.491 . . . . 0.0 110.357 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.2 mp -63.73 -45.68 96.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.01 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.857 ' HA ' HG21 ' A' ' 97' ' ' ILE . 71.7 mt -62.94 -44.94 99.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 121.141 0.496 . . . . 0.0 109.705 176.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.758 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.7 t70 -57.55 -44.55 85.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.429 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.46 -31.77 60.28 Favored Glycine 0 C--N 1.334 0.453 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.448 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.916 HG21 HD12 ' A' ' 97' ' ' ILE . 44.5 t -63.39 -51.62 68.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.271 173.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.62 -6.82 22.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.275 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.758 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 19.7 mtm180 -101.64 -47.77 4.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.045 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -115.56 -44.88 2.93 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.504 ' HB2' HG13 ' A' ' 124' ' ' VAL . 17.4 m-20 -70.96 -22.06 62.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.025 0.44 . . . . 0.0 111.049 -177.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -80.12 84.34 5.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -71.55 -26.65 62.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.756 -174.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . 0.476 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.6 m120 -76.45 -14.72 60.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.305 -173.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.7 t30 63.41 25.94 14.75 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.663 0.744 . . . . 0.0 109.221 -175.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -92.47 -15.0 27.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.837 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.5 -25.34 28.43 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.9 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.524 ' CD2' ' HA ' ' A' ' 89' ' ' ASP . 14.2 m-85 -116.42 162.79 17.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.176 -176.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.609 HG22 ' HB2' ' A' ' 88' ' ' LEU . 7.3 tt -96.65 130.89 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.465 0.65 . . . . 0.0 110.263 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -103.02 172.03 7.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.53 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.812 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 11.2 t80 -53.25 -48.03 68.57 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 123.135 0.272 . . . . 0.0 110.752 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -64.44 -31.21 72.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.485 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -75.87 -52.43 10.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.573 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.812 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.0 p90 -70.16 -28.05 65.02 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.397 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.57 -40.37 96.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 120.941 0.401 . . . . 0.0 110.447 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.8 mtmt -74.14 -28.81 61.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.762 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 13.7 t -80.94 -33.86 33.72 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.97 -174.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.0 pp . . . . . 0 CA--C 1.533 0.3 0 O-C-N 122.336 -0.228 . . . . 0.0 111.502 -178.222 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.504 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 91.7 mmm . . . . . 0 N--CA 1.464 0.256 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.495 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -93.9 161.34 30.28 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.543 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 10.1 Cg_endo -52.29 -46.62 31.64 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.145 2.563 . . . . 0.0 113.82 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -61.63 -50.28 73.17 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.252 -172.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.437 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 7.8 pm0 -71.97 -28.94 63.76 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.398 176.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.507 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 13.0 mt -66.76 -21.13 66.07 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.3 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.55 ' HG2' HD12 ' A' ' 145' ' ' LEU . 24.8 mt-30 -69.35 -46.46 66.95 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 173.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.47 -21.93 66.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.757 172.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.507 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 25.5 t60 -69.99 -44.29 69.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.175 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.597 ' HE2' ' CD2' ' A' ' 145' ' ' LEU . 5.3 m-30 -67.58 -26.82 66.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.527 0.68 . . . . 0.0 109.371 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.641 ' HA ' HD11 ' A' ' 88' ' ' LEU . 48.6 t80 -74.87 -52.61 10.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 114.526 -1.215 . . . . 0.0 109.989 179.182 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.549 ' HA ' ' HE3' ' A' ' 78' ' ' LYS . 19.7 mmmt -81.15 -24.63 37.44 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -174.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 18.2 tpp -44.84 -46.06 10.53 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -172.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.723 ' CD2' ' HB3' ' A' ' 92' ' ' GLU . 1.8 p-80 -130.26 8.28 5.08 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.578 -169.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.645 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 29.3 t70 -84.49 64.84 8.64 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.961 0.886 . . . . 0.0 109.357 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -95.66 3.29 54.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.627 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -89.27 -14.24 36.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.14 26.63 71.84 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.557 -0.747 . . . . 0.0 113.85 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -109.03 -1.74 18.68 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.714 0.757 . . . . 0.0 112.259 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 67.99 14.31 9.32 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.365 0.416 . . . . 0.0 111.512 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.536 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.8 mm? -126.35 155.25 42.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.701 HD22 ' CD2' ' A' ' 80' ' ' HIS . 17.8 mt -111.69 113.63 26.12 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.201 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.27 176.12 6.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.546 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.03 -51.88 47.03 Favored Glycine 0 CA--C 1.518 0.223 0 N-CA-C 114.238 0.455 . . . . 0.0 114.238 -178.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.611 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.0 pp -73.81 -26.28 60.53 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.359 0.579 . . . . 0.0 110.77 -173.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.723 ' HB3' ' CD2' ' A' ' 80' ' ' HIS . 46.9 mt-10 -65.0 -54.8 24.69 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 122.112 0.958 . . . . 0.0 108.509 168.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.88 ' HB3' HG12 ' A' ' 97' ' ' ILE . 57.1 mt -60.46 -10.04 4.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.077 -1.419 . . . . 0.0 112.53 -175.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.68 ' HA ' HD13 ' A' ' 121' ' ' ILE . 85.0 p -51.49 -33.08 29.93 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.54 0.525 . . . . 0.0 111.55 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -90.26 -33.33 16.18 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.66 ' HB3' ' HE1' ' A' ' 80' ' ' HIS . . . -93.96 -32.21 13.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -168.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.881 HD12 HG21 ' A' ' 124' ' ' VAL . 35.3 mm -65.4 -23.18 32.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.267 0.556 . . . . 0.0 110.445 -177.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.769 HG23 HD21 ' A' ' 117' ' ' LEU . 13.4 m -60.07 -17.84 42.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.9 174.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -110.59 -38.3 5.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.032 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.767 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 54.9 t -56.85 -59.53 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.116 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . 0.431 ' CD2' HG13 ' A' ' 120' ' ' ILE . 7.7 t60 . . . . . 0 N--CA 1.449 -0.499 0 CA-C-O 121.401 0.62 . . . . 0.0 109.423 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.44 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.508 -0.639 0 CA-C-O 120.506 0.193 . . . . 0.0 111.002 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 11.8 Cg_endo -91.38 69.37 1.1 Allowed 'Trans proline' 0 N--CA 1.435 -1.921 0 C-N-CA 122.231 1.954 . . . . 0.0 111.678 175.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.8 mt -51.1 93.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.669 0.747 . . . . 0.0 110.967 173.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -100.82 -55.29 2.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.623 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.7 m -160.74 118.28 2.43 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.489 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.7 OUTLIER -55.41 -36.64 66.67 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -174.541 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -67.57 -49.67 62.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.108 0.48 . . . . 0.0 110.154 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.28 -36.93 74.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.202 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.769 HD21 HG23 ' A' ' 98' ' ' THR . 9.8 tp -66.44 -41.09 89.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.323 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.2 mt -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.392 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -70.77 -31.47 68.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.431 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.431 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.0 OUTLIER -62.02 -38.54 81.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.273 175.911 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.874 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -64.08 -41.6 92.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.914 176.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.705 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.1 t70 -62.3 -44.1 97.3 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.613 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.91 -30.24 56.65 Favored Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.492 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.881 HG21 HD12 ' A' ' 97' ' ' ILE . 42.7 t -63.67 -50.49 77.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.996 0.427 . . . . 0.0 110.362 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.27 -6.25 22.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.051 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.705 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 27.8 mtm-85 -98.88 -48.47 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.055 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -121.27 -39.65 2.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.537 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 21.6 m-20 -67.48 -21.89 65.49 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.031 0.443 . . . . 0.0 110.967 -178.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.525 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.7 t70 -76.1 92.64 3.23 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 166.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -78.96 -27.69 43.58 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.471 -168.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.51 4.84 36.34 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.974 -170.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.525 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 65.0 t30 57.35 53.29 7.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.133 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -108.49 -3.86 17.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.773 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.15 -18.9 37.92 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.94 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.536 ' HB2' HD12 ' A' ' 87' ' ' LEU . 48.8 m-85 -117.36 177.34 4.77 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.878 0.37 . . . . 0.0 110.025 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.573 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.3 tt -113.38 123.52 69.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.403 0.62 . . . . 0.0 109.492 174.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -101.62 -179.34 3.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.836 177.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.872 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 9.4 t80 -52.2 -51.19 59.65 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.579 0.549 . . . . 0.0 111.476 -173.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.54 -22.04 64.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -175.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.468 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 52.6 mt-10 -80.08 -50.8 9.83 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -174.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.872 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 5.0 p90 -71.44 -33.59 69.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.84 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.12 77.16 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.848 0.356 . . . . 0.0 110.821 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -73.08 -29.22 62.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.111 176.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 7.7 t -81.14 -18.9 44.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -174.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.758 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 91.3 mt . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.989 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.701 ' HB2' ' CD1' ' A' ' 72' ' ' LEU . 85.6 mmm . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.8 m -96.69 153.45 38.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.166 177.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -49.36 -43.1 39.28 Favored 'Trans proline' 0 N--CA 1.479 0.657 0 C-N-CA 122.931 2.421 . . . . 0.0 113.573 -173.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -56.72 -44.87 82.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.055 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 2.0 mm-40 -64.93 -43.8 91.58 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.279 174.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.701 ' CD1' ' HB2' ' A' ' 67' ' ' MET . 7.7 mp -57.2 -24.8 56.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -169.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.61 ' HG2' HD21 ' A' ' 145' ' ' LEU . 10.2 mt-30 -63.9 -50.42 68.81 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 173.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 34.2 tp -63.49 -24.07 67.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.011 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.579 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 13.7 t60 -66.62 -38.25 86.54 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 4.3 m-30 -71.92 -37.02 70.13 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.66 ' HA ' HD11 ' A' ' 88' ' ' LEU . 48.7 t80 -62.16 -52.75 62.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.943 178.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -80.24 -13.66 59.05 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.57 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.63 -45.83 9.8 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 124.044 0.84 . . . . 0.0 111.069 -171.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.485 ' CD2' ' HE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -139.54 9.97 2.46 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.966 -178.634 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.75 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 26.2 t70 -85.07 82.96 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.892 0.853 . . . . 0.0 109.758 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.485 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.7 OUTLIER -121.63 15.17 11.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.144 -177.254 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -95.12 -13.33 25.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.219 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 12.14 80.59 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.249 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -98.34 -4.15 35.55 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 117.394 0.597 . . . . 0.0 111.065 -178.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 58.38 34.4 23.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.605 176.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.451 HD22 ' HB2' ' A' ' 135' ' ' TYR . 7.9 mt -151.54 149.37 29.12 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.563 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.66 HD11 ' HA ' ' A' ' 77' ' ' PHE . 68.8 mt -94.81 113.21 24.94 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.973 0.416 . . . . 0.0 111.823 -177.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.485 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 8.9 t70 -91.71 167.0 12.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.391 177.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.86 -49.93 39.82 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.66 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -68.92 -29.22 67.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 117.413 0.606 . . . . 0.0 110.631 -176.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.75 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 50.8 mt-10 -69.83 -48.54 58.58 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.826 ' HB3' HG12 ' A' ' 97' ' ' ILE . 25.2 mt -65.26 -11.24 39.3 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.31 -178.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.672 ' HA ' HD13 ' A' ' 121' ' ' ILE . 65.9 m -58.46 -33.35 69.65 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.832 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -93.35 -27.67 16.63 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.217 0.532 . . . . 0.0 111.482 174.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . . . -86.51 -41.43 14.36 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -169.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.899 HG21 ' HA ' ' A' ' 121' ' ' ILE . 43.0 mm -64.43 -21.13 28.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.012 0.434 . . . . 0.0 110.692 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.717 HG22 ' HB1' ' A' ' 109' ' ' ALA . 2.6 m -58.12 -21.95 48.83 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.54 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 80.6 m-70 -115.16 -6.2 12.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.322 176.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.736 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 42.0 t -90.13 -46.39 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 120.771 0.32 . . . . 0.0 111.432 -179.987 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.717 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.512 -0.513 0 CA-C-O 120.343 0.116 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.78 72.56 6.46 Favored 'Trans proline' 0 N--CA 1.444 -1.42 0 C-N-CA 122.083 1.855 . . . . 0.0 111.795 173.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.23 80.44 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.921 0.867 . . . . 0.0 110.383 169.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.424 ' H ' ' HG2' ' A' ' 112' ' ' MET . 15.1 ptt? -98.94 -60.51 1.52 Allowed 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.668 -178.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.8 m -165.6 120.19 1.24 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.07 -35.29 66.8 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -172.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.2 -46.79 88.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.217 0.532 . . . . 0.0 110.544 179.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.03 -33.65 63.83 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.115 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.67 HD21 HG23 ' A' ' 98' ' ' THR . 17.0 tp -61.25 -39.01 88.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.998 175.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 51.3 mt -61.38 -44.01 97.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.129 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -68.27 -33.13 73.79 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.395 0.617 . . . . 0.0 110.331 176.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.48 -40.53 84.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.416 174.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.899 ' HA ' HG21 ' A' ' 97' ' ' ILE . 90.3 mt -61.79 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.146 177.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.76 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.7 t70 -58.7 -44.43 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.556 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.87 -33.89 50.59 Favored Glycine 0 C--N 1.332 0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.184 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.821 HG21 HD12 ' A' ' 97' ' ' ILE . 39.8 t -63.0 -53.84 41.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.582 0.23 . . . . 0.0 110.872 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.536 HD11 HD12 ' A' ' 93' ' ' LEU . 9.0 mp -63.95 -14.52 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.967 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.76 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.4 mtm180 -95.0 -50.14 5.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.251 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -117.7 -41.3 2.94 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -170.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.511 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -68.1 -18.79 64.75 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.523 0.678 . . . . 0.0 109.669 178.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.642 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 3.2 t70 -72.34 90.68 1.29 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.693 165.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -79.51 -16.85 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.276 -170.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -113.4 13.36 18.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -171.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.8 t30 53.8 50.11 17.67 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.27 173.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -110.9 -9.02 14.46 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.553 -0.459 . . . . 0.0 109.997 173.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 79.72 0.78 85.68 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.524 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.451 ' HB2' HD22 ' A' ' 87' ' ' LEU . 87.2 m-85 -126.08 175.35 7.81 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.593 HG22 ' HB2' ' A' ' 88' ' ' LEU . 10.2 tt -118.56 121.11 66.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.421 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -99.92 -176.87 3.37 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.308 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.847 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.2 t80 -53.41 -50.2 65.69 Favored 'General case' 0 C--O 1.225 -0.227 0 O-C-N 123.66 0.6 . . . . 0.0 111.812 -173.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.79 -35.14 78.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.768 0.318 . . . . 0.0 110.756 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.642 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 48.9 mt-10 -66.21 -53.79 32.94 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.815 -174.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.847 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -73.08 -32.03 64.74 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.798 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.61 97.73 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.124 0.487 . . . . 0.0 110.117 178.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -70.09 -29.03 65.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.927 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 9.6 t -82.45 -32.78 28.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.608 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.61 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.5 pp . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 121.205 0.526 . . . . 0.0 111.065 -179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.649 ' HB2' HD21 ' A' ' 72' ' ' LEU . 97.7 mmm . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 110.45 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.48 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 49.1 m -97.79 161.96 23.95 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.324 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.525 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.8 Cg_exo -50.83 -46.48 30.18 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.94 2.426 . . . . 0.0 114.57 -172.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -59.6 -49.23 78.55 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.48 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 1.6 pm0 -78.35 -26.13 46.6 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 122.048 -0.407 . . . . 0.0 111.121 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.649 HD21 ' HB2' ' A' ' 67' ' ' MET . 11.8 mt -64.41 -20.02 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.533 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 29.6 mt-30 -73.35 -43.04 61.51 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 51.5 tp -65.61 -23.82 66.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.715 173.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.515 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 46.3 t60 -64.3 -37.29 86.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 176.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.461 ' HD1' HG22 ' A' ' 100' ' ' VAL . 4.2 m-30 -69.26 -35.31 75.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.629 177.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.574 ' HD1' ' HE2' ' A' ' 141' ' ' PHE . 62.9 t80 -68.72 -50.33 51.67 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.514 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -80.05 -13.71 59.1 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.361 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -45.06 -41.29 7.49 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.94 0.775 . . . . 0.0 112.937 -172.035 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.586 ' HB3' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -141.49 10.52 2.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.904 -178.052 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.677 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 23.5 t70 -82.83 81.93 8.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.823 0.82 . . . . 0.0 109.681 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.56 15.62 18.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.723 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.0 p30 -99.69 -13.14 19.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.88 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 71.2 29.42 68.63 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.021 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -106.83 -3.58 20.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.477 0.638 . . . . 0.0 111.342 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 60.65 42.42 13.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.586 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.497 HD22 ' HB2' ' A' ' 135' ' ' TYR . 6.0 mt -158.3 153.56 25.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.419 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.582 ' HB2' HG22 ' A' ' 136' ' ' ILE . 96.4 mt -106.15 113.34 26.82 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.912 0.387 . . . . 0.0 111.29 178.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.516 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 16.8 t70 -87.33 157.57 19.25 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.744 172.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -46.93 -35.74 8.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.671 -177.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.516 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 36.0 mt -65.42 -40.71 93.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.975 0.417 . . . . 0.0 111.656 -178.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.677 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 27.9 mt-10 -74.6 -44.22 51.79 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.549 1.166 . . . . 0.0 108.82 172.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.931 ' HG ' HG12 ' A' ' 97' ' ' ILE . 10.7 tp -63.77 -12.97 39.81 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 113.286 -1.779 . . . . 0.0 111.917 -169.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.885 ' HA ' HD13 ' A' ' 121' ' ' ILE . 40.9 p -51.82 -48.77 63.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.419 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -78.29 -26.94 47.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.205 0.526 . . . . 0.0 111.397 -176.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.62 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -80.98 -42.5 21.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.657 -173.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.931 HG12 ' HG ' ' A' ' 93' ' ' LEU . 45.1 mm -66.05 -17.41 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.043 0.449 . . . . 0.0 111.151 -177.303 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.632 HG23 HD21 ' A' ' 117' ' ' LEU . 2.0 m -63.69 -15.13 57.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 175.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -115.58 -32.98 5.37 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.449 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.789 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.3 t -59.86 -53.78 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.77 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 32.6 t-80 . . . . . 0 C--O 1.234 0.241 0 CA-C-O 121.001 0.429 . . . . 0.0 110.499 178.479 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.578 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.509 -0.625 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . 0.419 ' O ' ' HG2' ' A' ' 112' ' ' MET . 7.4 Cg_exo -73.29 60.31 3.97 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.364 2.043 . . . . 0.0 111.68 177.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.66 77.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.114 0.959 . . . . 0.0 110.979 174.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 110' ' ' PRO . 8.0 ptt? -95.44 -59.1 1.95 Allowed 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.718 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.418 ' H ' ' HG3' ' A' ' 112' ' ' MET . 40.3 m -160.59 118.58 2.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.499 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.0 pt-20 -52.54 -37.02 56.79 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -172.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -66.3 -42.05 88.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.979 0.418 . . . . 0.0 110.471 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -75.35 -29.06 59.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.315 178.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.632 HD21 HG23 ' A' ' 98' ' ' THR . 13.8 tp -65.0 -38.54 91.3 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 173.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 114' ' ' GLU . 90.6 mt -62.07 -43.1 97.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.249 172.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -63.43 -34.96 78.88 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.084 0.469 . . . . 0.0 110.407 175.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -39.56 85.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.38 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.885 HD13 ' HA ' ' A' ' 94' ' ' SER . 78.5 mt -66.27 -41.78 89.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.429 0.633 . . . . 0.0 109.865 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.795 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 29.6 t70 -62.33 -44.25 96.92 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.666 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . 0.489 ' HA2' ' HD3' ' A' ' 126' ' ' ARG . . . -54.3 -34.37 53.86 Favored Glycine 0 C--N 1.334 0.46 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.998 176.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.923 HG21 HD12 ' A' ' 97' ' ' ILE . 39.0 t -59.07 -53.41 48.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.886 0.375 . . . . 0.0 110.196 172.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 62.7 mt -68.46 -0.77 5.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.618 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.795 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.9 mtp180 -103.43 -47.98 4.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.681 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -121.38 -38.23 2.81 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -173.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.538 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -75.77 -16.49 60.12 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.192 0.52 . . . . 0.0 110.805 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.604 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.5 t70 -78.9 87.24 4.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 169.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -74.88 -32.79 61.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.139 -168.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.98 -3.09 58.95 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.609 -176.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.604 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 18.7 m120 60.71 43.24 12.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.018 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.1 p30 -98.17 -12.58 21.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.358 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.68 4.29 89.05 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.335 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.497 ' HB2' HD22 ' A' ' 87' ' ' LEU . 59.2 m-85 -129.56 -179.85 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 175.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.582 HG22 ' HB2' ' A' ' 88' ' ' LEU . 8.9 tt -120.81 120.74 63.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.43 0.633 . . . . 0.0 110.142 174.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -97.22 -178.09 4.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.823 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 21.5 t80 -55.21 -49.04 72.97 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.413 0.446 . . . . 0.0 111.669 -172.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.64 -31.49 71.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.489 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.55 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.7 mt-10 -68.69 -51.26 43.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.404 -176.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.823 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.8 p90 -74.98 -32.48 61.69 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.734 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -61.08 -45.45 94.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.956 0.408 . . . . 0.0 110.074 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -65.62 -30.15 70.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.22 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 8.0 t -82.67 -37.01 25.43 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.831 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 3.8 pp . . . . . 0 N--CA 1.463 0.217 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.206 -176.431 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.618 ' HE1' ' HA ' ' A' ' 72' ' ' LEU . 51.8 mtp . . . . . 0 CA--C 1.52 -0.177 0 CA-C-O 121.057 0.455 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 3.9 m -91.44 152.91 44.11 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.738 177.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.58 -49.05 18.8 Favored 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.237 1.958 . . . . 0.0 113.698 -176.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.56 ' HA ' HE21 ' A' ' 73' ' ' GLN . 19.0 pt20 -60.42 -41.02 93.1 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.451 -175.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 68' ' ' SER . 12.9 pt-20 -75.74 -33.94 60.28 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.751 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.635 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -64.95 -21.68 66.87 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.329 0.585 . . . . 0.0 111.309 -174.532 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.56 HE21 ' HA ' ' A' ' 70' ' ' GLN . 46.6 mt-30 -73.09 -43.47 61.76 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 175.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.59 -20.86 66.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.911 172.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.635 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 39.0 t60 -64.65 -44.1 91.51 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 120.856 0.36 . . . . 0.0 110.348 175.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.74 ' CD1' HG22 ' A' ' 100' ' ' VAL . 3.8 m-30 -66.34 -25.97 67.07 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.24 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.759 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.6 t80 -74.17 -53.75 9.2 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.297 177.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.759 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.4 mmmt -80.63 -12.72 59.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.331 -173.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.466 ' HG2' ' HA ' ' A' ' 96' ' ' ALA . 1.0 OUTLIER -45.51 -35.69 4.03 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.981 0.801 . . . . 0.0 112.244 -174.149 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.79 10.58 1.06 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.575 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 30.1 t70 -84.55 81.71 8.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.909 0.861 . . . . 0.0 110.337 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -99.31 -6.88 27.16 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.286 177.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -95.8 -14.52 23.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.614 -174.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 66.37 23.96 72.01 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 114.911 0.724 . . . . 0.0 114.911 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -84.47 3.54 35.84 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.299 1.049 . . . . 0.0 111.026 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.621 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 29.2 m-80 59.52 28.0 17.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.531 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.0 mt -148.99 167.45 25.77 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.958 177.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.534 ' HB2' HG22 ' A' ' 136' ' ' ILE . 13.0 mt -135.26 122.08 21.04 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.201 -179.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -103.67 -170.52 1.79 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -51.21 -38.67 40.85 Favored Glycine 0 CA--C 1.521 0.468 0 O-C-N 123.399 0.437 . . . . 0.0 113.978 -174.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.2 mt -67.75 -41.25 83.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.354 0.597 . . . . 0.0 111.09 -175.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.575 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 40.1 mt-10 -74.69 -45.79 42.05 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.624 0.726 . . . . 0.0 109.886 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.572 ' HB3' HG12 ' A' ' 97' ' ' ILE . 21.7 mt -63.92 -20.36 65.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.98 -1.009 . . . . 0.0 113.148 -172.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.769 ' HA ' HD13 ' A' ' 121' ' ' ILE . 53.4 p -53.53 -36.7 62.08 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.735 0.302 . . . . 0.0 111.624 -177.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -90.04 -33.4 16.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 0.0 111.141 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.598 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.16 -47.47 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.738 -171.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.879 HD12 HG21 ' A' ' 124' ' ' VAL . 36.5 mm -59.44 -22.75 23.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.612 -174.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.835 HG23 HD21 ' A' ' 117' ' ' LEU . 18.5 m -58.88 -18.24 31.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.308 175.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.472 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 85.4 m-70 -113.96 -17.27 12.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.403 176.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.74 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.4 t -88.27 -51.6 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.138 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . 0.504 ' CD2' HG13 ' A' ' 120' ' ' ILE . 52.7 t60 . . . . . 0 C--N 1.332 -0.194 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.861 -177.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.472 ' HB2' ' CE1' ' A' ' 99' ' ' HIS . . . . . . . . 0 CA--C 1.509 -0.624 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -83.11 64.36 7.86 Favored 'Trans proline' 0 N--CA 1.439 -1.72 0 C-N-CA 122.03 1.82 . . . . 0.0 110.874 176.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 46.8 tp -63.08 81.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 122.002 0.906 . . . . 0.0 111.054 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.417 ' H ' ' HG2' ' A' ' 112' ' ' MET . 8.9 ptt? -89.62 -56.09 3.39 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.366 178.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.6 m -159.8 123.57 3.7 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 177.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.577 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.51 -40.86 65.74 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.742 -172.505 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 34.1 t70 -71.12 -39.88 71.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -67.48 -37.15 82.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.355 0.598 . . . . 0.0 109.597 174.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.835 HD21 HG23 ' A' ' 98' ' ' THR . 11.9 tp -61.86 -32.87 73.26 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.048 177.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.577 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.7 mt -62.78 -43.96 99.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.416 174.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . 0.508 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 16.6 m120 -69.02 -24.17 64.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.183 0.516 . . . . 0.0 110.607 176.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.504 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -66.07 -39.0 83.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.575 0.702 . . . . 0.0 109.505 173.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.789 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -68.5 -38.76 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.379 174.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.611 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 94.4 m-20 -53.41 -49.55 67.04 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.732 172.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.81 -34.23 36.76 Favored Glycine 0 CA--C 1.508 -0.354 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.981 178.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.879 HG21 HD12 ' A' ' 97' ' ' ILE . 76.7 t -68.0 -51.78 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-O 120.801 0.334 . . . . 0.0 110.939 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.426 HD21 HD12 ' A' ' 93' ' ' LEU . 54.6 mt -67.72 -11.47 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.948 -177.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.611 ' NH1' ' HB3' ' A' ' 122' ' ' ASP . 48.8 mtt180 -105.64 -32.18 8.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.5 -177.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -132.18 -44.62 0.94 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -171.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.572 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 39.7 m-20 -71.62 -19.72 62.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.693 0.282 . . . . 0.0 111.468 -176.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.534 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -77.06 99.72 5.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 167.422 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -80.87 -19.08 45.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.904 -170.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 -3.65 29.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.549 -171.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 66.68 33.06 6.59 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.427 0.454 . . . . 0.0 111.376 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -97.08 -8.77 29.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.108 0.48 . . . . 0.0 110.056 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . 0.413 ' C ' ' HD2' ' A' ' 135' ' ' TYR . . . 79.97 -8.56 50.3 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.946 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.413 ' HD2' ' C ' ' A' ' 134' ' ' GLY . 5.3 m-30 -115.58 167.09 11.21 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.563 HG22 HD21 ' A' ' 93' ' ' LEU . 8.1 tt -111.76 118.2 57.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.792 0.806 . . . . 0.0 110.436 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -88.13 168.84 12.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.067 177.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.819 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.0 t80 -50.43 -47.67 56.57 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 123.084 0.24 . . . . 0.0 110.406 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.16 75.15 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 120.757 0.313 . . . . 0.0 111.379 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.534 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 45.3 mt-10 -68.68 -54.86 13.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.444 -176.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.819 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -70.72 -30.54 67.1 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.49 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.471 ' O ' ' HG ' ' A' ' 145' ' ' LEU . . . -61.69 -50.23 73.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 176.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -63.82 -32.39 73.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.099 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 15.9 t -77.7 -28.59 51.05 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.385 -177.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.49 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp . . . . . 0 CA--C 1.53 0.194 0 O-C-N 122.412 -0.18 . . . . 0.0 111.107 -179.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.67 ' HB2' HD21 ' A' ' 72' ' ' LEU . 89.6 mmm . . . . . 0 N--CA 1.461 0.115 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.503 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -88.43 153.09 50.59 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.297 0.094 . . . . 0.0 111.196 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.89 -44.02 43.94 Favored 'Trans proline' 0 N--CA 1.476 0.492 0 C-N-CA 123.307 2.671 . . . . 0.0 114.701 -170.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -59.48 -49.06 79.23 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.741 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -74.5 -26.27 59.9 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.586 175.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.67 HD21 ' HB2' ' A' ' 67' ' ' MET . 17.2 mt -63.34 -18.89 64.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.405 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 17.6 mt-30 -71.71 -45.43 61.85 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.43 -21.02 66.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.566 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.581 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 7.9 t60 -66.9 -40.31 87.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.106 177.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.615 ' HE2' HD21 ' A' ' 145' ' ' LEU . 5.9 m-30 -68.39 -32.99 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.545 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 57.3 t80 -71.02 -51.17 26.94 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.296 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -80.56 -16.91 53.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.868 -175.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.0 tpp -44.35 -48.69 9.72 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.646 0.591 . . . . 0.0 112.404 -172.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.575 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -130.68 10.22 5.11 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.88 -175.584 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.726 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 26.5 t70 -80.47 75.15 7.33 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.68 0.752 . . . . 0.0 110.005 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -91.53 -15.27 28.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.122 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.6 p30 -76.41 -14.24 60.08 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 -177.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.82 30.57 77.49 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.483 -0.78 . . . . 0.0 113.065 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -101.36 3.45 40.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 117.294 0.547 . . . . 0.0 111.229 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 64.15 34.51 10.98 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.335 0.588 . . . . 0.0 110.479 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.509 ' HB3' ' CD2' ' A' ' 135' ' ' TYR . 15.6 mt -157.23 158.33 35.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.88 178.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.526 HD11 ' HA ' ' A' ' 77' ' ' PHE . 88.3 mt -120.15 121.43 38.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.82 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.464 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 0.6 OUTLIER -92.24 -177.45 4.66 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.399 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -55.85 -37.09 68.36 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.295 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.464 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 26.0 mt -68.66 -47.75 65.73 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.141 0.496 . . . . 0.0 110.368 -177.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.726 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 45.2 mt-10 -64.11 -42.23 96.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.87 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.634 HD21 HG22 ' A' ' 136' ' ' ILE . 24.1 mt -66.55 -18.39 65.34 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.792 -175.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.639 ' HA ' HD13 ' A' ' 121' ' ' ILE . 46.4 t -57.1 -32.06 65.91 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.689 0.28 . . . . 0.0 111.048 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.88 -31.01 15.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.069 0.461 . . . . 0.0 111.188 178.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.57 -43.73 12.46 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.867 HD12 HG21 ' A' ' 124' ' ' VAL . 39.7 mm -64.77 -25.91 38.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -175.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.618 HG22 ' HB1' ' A' ' 109' ' ' ALA . 17.9 m -58.47 -20.27 43.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.724 174.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 68.3 m-70 -109.44 -27.07 9.66 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 173.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.768 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 38.4 t -67.48 -58.66 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.719 0.295 . . . . 0.0 111.173 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 12.4 t60 . . . . . 0 N--CA 1.452 -0.325 0 CA-C-O 121.364 0.602 . . . . 0.0 110.026 -177.831 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.618 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.505 -0.762 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 3.7 Cg_exo -78.19 65.99 8.37 Favored 'Trans proline' 0 N--CA 1.443 -1.486 0 C-N-CA 121.745 1.63 . . . . 0.0 111.228 177.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.62 81.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.864 0.84 . . . . 0.0 111.095 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.409 ' CG ' ' H ' ' A' ' 113' ' ' SER . 14.4 ptt? -98.23 -57.81 2.12 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.005 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.409 ' H ' ' CG ' ' A' ' 112' ' ' MET . 73.6 m -162.39 124.58 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.516 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.25 -37.88 65.18 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.132 -173.939 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.78 -43.93 82.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.026 0.441 . . . . 0.0 110.662 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.08 -39.73 86.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.344 0.592 . . . . 0.0 109.932 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.574 HD13 HG23 ' A' ' 98' ' ' THR . 10.8 mt -62.66 -37.67 87.33 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.99 175.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 114' ' ' GLU . 63.6 mt -60.82 -42.98 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.032 0.444 . . . . 0.0 110.619 172.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -67.36 -29.81 69.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.222 0.534 . . . . 0.0 110.479 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.44 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.0 OUTLIER -65.57 -34.49 70.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.885 174.656 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.852 ' HA ' HG21 ' A' ' 97' ' ' ILE . 88.4 mt -67.26 -38.34 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.8 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.805 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.9 t70 -60.79 -46.0 92.21 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.232 176.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.56 -37.75 41.91 Favored Glycine 0 C--N 1.334 0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.007 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 54.8 t -63.58 -51.04 75.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 110.417 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.8 mt -65.02 -7.48 12.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.45 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.805 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 13.6 mtm180 -106.42 -49.33 3.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.847 0.356 . . . . 0.0 110.791 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -113.13 -44.19 3.29 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -169.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.51 ' HB2' HG13 ' A' ' 124' ' ' VAL . 27.3 m-20 -71.8 -23.89 61.64 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.151 0.5 . . . . 0.0 110.028 -177.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.607 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 4.6 t70 -76.05 88.22 2.98 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 168.006 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.5 -21.51 57.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.477 -169.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -108.14 6.46 26.85 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.168 -170.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.459 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 44.1 m-80 58.41 38.96 25.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 175.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.9 p30 -96.74 -13.27 22.8 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.308 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.18 2.69 90.45 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.312 178.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.509 ' CD2' ' HB3' ' A' ' 87' ' ' LEU . 28.5 m-85 -124.7 173.43 8.55 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.634 HG22 HD21 ' A' ' 93' ' ' LEU . 6.7 tt -116.18 123.41 71.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.424 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.5 p30 -101.03 -179.69 4.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.837 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 4.3 t80 -53.65 -50.31 66.05 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 123.558 0.537 . . . . 0.0 111.209 -174.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.63 -20.43 64.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.68 -176.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.607 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -80.12 -52.92 7.19 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 -176.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.837 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -70.14 -33.31 71.63 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.274 178.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.37 -41.23 93.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.845 0.355 . . . . 0.0 110.732 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.447 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 31.7 mtmm -70.69 -28.44 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.931 176.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 14.9 t -80.87 -17.33 51.03 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -175.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.767 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 85.8 mt . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.419 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.681 ' HB2' HD21 ' A' ' 72' ' ' LEU . 94.0 mmm . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.17 158.38 39.33 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-O 119.635 -0.221 . . . . 0.0 110.48 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.601 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 9.6 Cg_endo -52.34 -43.34 54.64 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.904 2.403 . . . . 0.0 113.618 -173.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -54.03 51.38 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.933 -175.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.8 pm0 -72.36 -28.76 63.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.679 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.786 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 25.7 mt -63.87 -19.7 65.27 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.965 0.412 . . . . 0.0 110.938 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.782 ' HG2' HD21 ' A' ' 145' ' ' LEU . 17.8 mt-30 -66.15 -39.32 89.72 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 174.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.529 ' HG ' ' HG2' ' A' ' 78' ' ' LYS . 30.8 tp -77.22 -19.17 57.03 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.835 173.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.786 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 19.7 t60 -73.32 -38.67 65.74 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.68 ' CD2' HG22 ' A' ' 100' ' ' VAL . 6.9 m-30 -68.14 -41.61 81.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.035 175.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.664 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 50.0 t80 -66.37 -52.64 44.7 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.522 -175.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.664 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.6 mmmt -77.71 -15.77 58.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.989 -175.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.415 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 35.4 tpp -45.39 -44.87 12.28 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 123.84 0.712 . . . . 0.0 111.883 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.542 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -132.48 7.68 4.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.404 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.512 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 24.0 t70 -92.75 85.35 5.19 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.832 0.825 . . . . 0.0 109.487 178.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.542 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 23.0 m-85 -96.64 -8.89 30.48 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.209 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -88.63 -16.37 32.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.732 -175.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.72 28.17 65.13 Favored Glycine 0 CA--C 1.524 0.637 0 CA-C-N 115.886 -0.597 . . . . 0.0 113.764 176.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . 0.45 ' O ' ' HB3' ' A' ' 86' ' ' ASN . 18.9 p-10 -95.44 18.1 13.31 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 117.412 0.606 . . . . 0.0 111.5 -174.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 85' ' ' ASN . 4.3 t-20 76.48 -27.09 0.18 Allowed 'General case' 0 N--CA 1.47 0.557 0 O-C-N 123.782 0.676 . . . . 0.0 112.046 175.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.6 mm? -112.81 162.63 15.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.105 0.955 . . . . 0.0 112.459 -176.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.507 HD21 ' HB2' ' A' ' 81' ' ' ASP . 1.3 mt -132.26 123.38 26.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.612 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.433 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.0 p-10 -96.25 175.44 6.44 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.41 -37.32 12.14 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 114.108 0.403 . . . . 0.0 114.108 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.433 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 54.6 mt -65.13 -52.52 54.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.468 0.634 . . . . 0.0 110.707 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.512 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 43.9 mt-10 -61.47 -54.67 40.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.307 1.051 . . . . 0.0 109.33 174.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.995 ' HG ' HG12 ' A' ' 97' ' ' ILE . 5.5 tp -66.45 -9.82 37.99 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.836 -1.529 . . . . 0.0 112.917 -166.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 1.065 ' HA ' HD13 ' A' ' 121' ' ' ILE . 58.8 p -56.13 -45.32 79.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 111.343 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -23.53 51.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.218 0.532 . . . . 0.0 111.188 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.588 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -86.42 -58.38 2.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.37 -175.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.995 HG12 ' HG ' ' A' ' 93' ' ' LEU . 24.4 mm -61.85 -20.36 23.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.281 -172.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.788 HG23 HD21 ' A' ' 117' ' ' LEU . 99.3 m -53.33 -31.52 44.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.081 0.467 . . . . 0.0 110.832 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 57.3 m-70 -94.82 -37.16 11.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.112 0.482 . . . . 0.0 110.823 176.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.939 HG21 ' HE1' ' A' ' 141' ' ' PHE . 2.1 t -72.57 -50.93 31.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.033 -170.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . 0.582 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.7 t60 . . . . . 0 N--CA 1.452 -0.345 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.57 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.506 -0.737 0 CA-C-O 120.479 0.181 . . . . 0.0 111.012 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . 0.57 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.1 Cg_endo -77.78 67.37 7.97 Favored 'Trans proline' 0 N--CA 1.445 -1.373 0 C-N-CA 121.422 1.415 . . . . 0.0 111.492 174.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.55 80.69 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.886 0.85 . . . . 0.0 111.33 173.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.437 ' H ' ' HG2' ' A' ' 112' ' ' MET . 12.2 ptt? -86.59 -56.81 3.25 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.244 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.0 m -163.7 126.36 2.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.423 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -51.15 -38.91 54.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.554 -174.052 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.3 -50.44 65.68 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.048 0.451 . . . . 0.0 111.068 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -64.61 -35.05 79.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.524 0.678 . . . . 0.0 109.946 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.788 HD21 HG23 ' A' ' 98' ' ' THR . 15.7 tp -65.09 -41.62 94.82 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.368 178.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 114' ' ' GLU . 55.0 mt -61.56 -42.1 92.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.581 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . 0.429 ' O ' ' HB3' ' A' ' 122' ' ' ASP . 91.8 m-20 -71.62 -23.92 61.79 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.218 0.533 . . . . 0.0 110.71 176.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.582 HG13 ' CD2' ' A' ' 101' ' ' HIS . 0.9 OUTLIER -68.31 -33.66 61.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.303 0.573 . . . . 0.0 109.935 174.065 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 1.065 HD13 ' HA ' ' A' ' 94' ' ' SER . 58.8 mt -75.16 -17.69 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 121.636 0.731 . . . . 0.0 109.861 174.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 19.9 t70 -75.44 -36.76 60.69 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.37 -37.27 80.65 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.671 -1.15 . . . . 0.0 113.148 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.669 HG12 ' O ' ' A' ' 121' ' ' ILE . 7.2 p -60.46 -43.34 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 CA-C-N 117.555 0.677 . . . . 0.0 109.97 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.24 -13.82 62.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.082 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.68 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 28.6 mtm-85 -99.22 -50.1 4.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.563 -178.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -119.07 -20.98 7.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -168.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.569 ' HB2' HG23 ' A' ' 124' ' ' VAL . 41.5 m-20 -89.89 -27.89 19.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.423 178.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.503 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -77.68 94.41 4.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.639 0.733 . . . . 0.0 109.316 172.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -80.42 -32.38 37.4 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.217 -0.902 . . . . 0.0 111.462 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.1 -0.18 56.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.676 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.503 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 73.5 m-20 63.88 28.08 14.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.7 176.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.8 p30 -84.06 -13.58 52.73 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.993 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 86.26 1.36 86.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.561 176.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.574 ' HB2' HD12 ' A' ' 87' ' ' LEU . 33.4 m-85 -130.54 176.41 8.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.458 HD12 ' CG2' ' A' ' 124' ' ' VAL . 6.3 tt -111.01 123.57 67.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.269 174.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.97 167.79 11.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.963 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.403 ' HE1' ' HA ' ' A' ' 74' ' ' LEU . 11.2 t80 -51.9 -41.2 61.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.605 0.184 . . . . 0.0 111.397 -178.108 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.78 -44.58 92.96 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.733 0.301 . . . . 0.0 110.693 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.464 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 46.5 mt-10 -67.13 -41.47 86.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.939 ' HE1' HG21 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -59.99 -54.77 42.12 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.496 178.013 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . 0.541 ' O ' ' HG ' ' A' ' 145' ' ' LEU . . . -57.34 -47.04 82.61 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.875 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -65.38 -34.52 78.5 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.854 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.8 t -75.36 -29.75 59.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.939 0.4 . . . . 0.0 110.65 -177.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.782 HD21 ' HG2' ' A' ' 73' ' ' GLN . 3.9 pp . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.339 -178.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.605 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 97.3 mmm . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 120.949 0.404 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.5 m -81.59 155.1 71.32 Favored Pre-proline 0 C--O 1.223 -0.329 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.656 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.454 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.4 Cg_exo -53.97 -51.39 10.81 Favored 'Trans proline' 0 N--CA 1.477 0.52 0 C-N-CA 122.659 2.239 . . . . 0.0 114.609 -173.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -67.2 -35.85 80.48 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.34 0.59 . . . . 0.0 110.358 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.486 ' HG2' ' CE ' ' A' ' 67' ' ' MET . 5.5 tp10 -58.04 -53.3 59.85 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.928 173.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.662 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 24.3 mt -58.07 -23.26 53.93 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 113.808 -1.542 . . . . 0.0 112.933 -175.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 13.7 mt-30 -70.93 -41.74 70.79 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 175.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.56 -25.53 66.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.141 171.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.662 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 11.3 t60 -64.38 -40.68 96.29 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.08 174.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.5 ' OH ' ' HB3' ' A' ' 99' ' ' HIS . 3.6 m-30 -67.93 -30.72 70.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.235 0.54 . . . . 0.0 109.995 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.688 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.4 t80 -69.43 -51.83 32.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.762 177.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.688 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.4 mmmt -79.36 -12.51 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.412 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.4 tpt -44.88 -36.83 3.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.989 0.915 . . . . 0.0 112.688 -172.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.518 ' HA ' ' CE2' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -147.57 10.23 0.95 Allowed 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.867 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.732 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 28.6 t70 -86.38 88.22 7.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.319 0.58 . . . . 0.0 110.396 -178.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.518 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 29.0 m-85 -112.02 -0.92 15.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.944 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -85.12 -13.82 49.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.043 -171.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.69 13.95 81.71 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.167 -0.54 . . . . 0.0 113.363 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -92.97 -5.29 51.02 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.712 0.756 . . . . 0.0 110.781 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 62.47 20.01 11.6 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.596 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.51 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.3 mm? -132.32 153.18 50.98 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.212 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.719 ' HB2' HG22 ' A' ' 136' ' ' ILE . 3.9 mm? -106.59 114.53 28.69 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.173 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.498 ' OD2' ' HG3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -93.77 -178.91 4.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.3 178.819 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.09 -51.04 48.91 Favored Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 114.309 0.484 . . . . 0.0 114.309 -176.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.609 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.4 pp -73.8 -28.45 61.65 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.115 0.457 . . . . 0.0 110.875 -174.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.732 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 50.4 mt-10 -66.68 -52.15 48.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 0.861 ' HB3' HG12 ' A' ' 97' ' ' ILE . 30.3 mt -66.71 -7.38 20.53 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.393 -177.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.729 ' HA ' HD13 ' A' ' 121' ' ' ILE . 75.4 m -56.84 -31.77 65.09 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.109 176.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -91.61 -32.17 15.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.074 0.464 . . . . 0.0 111.15 175.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -84.29 -41.7 16.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.226 -169.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.885 ' HB ' HG12 ' A' ' 121' ' ' ILE . 40.2 mm -68.05 -17.85 22.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -177.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.835 HG23 HD13 ' A' ' 117' ' ' LEU . 4.7 m -60.01 -25.91 65.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.166 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.5 ' HB3' ' OH ' ' A' ' 76' ' ' TYR . 62.2 m-70 -103.5 -33.56 9.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.663 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.829 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 32.6 t -58.59 -51.41 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 177.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.6 t60 . . . . . 0 C--O 1.233 0.2 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 167.494 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.572 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.507 -0.689 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 98' ' ' THR . 53.4 Cg_endo -79.65 65.67 8.86 Favored 'Trans proline' 0 N--CA 1.441 -1.56 0 C-N-CA 121.552 1.501 . . . . 0.0 111.323 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -49.84 94.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.505 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -106.94 -47.78 3.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.064 -179.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.4 m 179.99 117.96 0.05 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -177.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.538 ' O ' HG13 ' A' ' 118' ' ' ILE . 16.3 pt-20 -56.76 -36.69 70.1 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.794 -175.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -66.78 -45.63 77.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.833 0.349 . . . . 0.0 110.182 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.09 -44.32 96.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.644 0.735 . . . . 0.0 109.888 177.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.835 HD13 HG23 ' A' ' 98' ' ' THR . 11.7 mt -60.23 -37.7 81.13 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.699 -1.137 . . . . 0.0 111.521 176.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.705 ' HA ' HD12 ' A' ' 121' ' ' ILE . 61.8 mt -61.07 -37.34 77.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.839 0.352 . . . . 0.0 110.91 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -65.38 -38.14 89.14 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.477 0.656 . . . . 0.0 109.266 174.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.417 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -61.57 -42.16 92.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.765 174.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.885 HG12 ' HB ' ' A' ' 97' ' ' ILE . 93.3 mt -60.52 -36.93 73.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.603 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.829 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 33.9 t70 -61.31 -43.64 98.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.59 -29.04 60.52 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.718 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.799 HG21 HD12 ' A' ' 97' ' ' ILE . 79.1 t -65.01 -53.81 36.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.494 0.187 . . . . 0.0 110.759 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 67.4 mt -65.65 -14.11 60.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.37 -175.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.829 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 15.9 mtp85 -103.66 -36.0 8.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.105 -177.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -124.08 -47.08 1.92 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -170.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.583 ' HB3' HG13 ' A' ' 124' ' ' VAL . 12.6 t70 -71.91 -19.29 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.77 0.795 . . . . 0.0 109.809 -178.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.536 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 1.6 t70 -72.56 90.85 1.37 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.689 166.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -79.19 -27.9 42.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.214 -170.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -88.26 -3.66 58.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.76 -176.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.536 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 14.1 t30 61.65 49.48 4.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.586 0.708 . . . . 0.0 110.727 179.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 52.8 p30 -107.62 -8.29 16.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.516 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.37 1.31 90.41 Favored Glycine 0 C--N 1.329 0.183 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.055 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.51 ' HB2' HD12 ' A' ' 87' ' ' LEU . 50.4 m-85 -131.21 178.02 7.02 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 174.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.719 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.1 tt -114.97 126.21 72.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.217 0.532 . . . . 0.0 109.607 175.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -102.78 -178.22 3.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.704 175.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.835 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 44.1 t80 -56.75 -46.91 81.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 123.341 0.4 . . . . 0.0 111.598 -172.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.2 -28.27 67.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.646 0.26 . . . . 0.0 111.344 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.496 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.5 mt-10 -72.74 -56.37 5.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.231 -175.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.835 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.9 p90 -70.6 -27.72 64.3 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.159 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.52 -34.24 77.76 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.337 179.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.418 ' HB2' ' HE3' ' A' ' 143' ' ' LYS . 47.4 mtmt -76.7 -32.61 57.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.374 177.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . 0.551 ' OG ' ' HA ' ' A' ' 141' ' ' PHE . 1.3 p -82.27 -30.36 30.68 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.572 -174.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.5 pp . . . . . 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.512 178.56 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.565 ' HB2' HD21 ' A' ' 72' ' ' LEU . 92.3 mmm . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.49 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 6.3 m -76.4 160.7 77.0 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -178.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.49 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 9.9 Cg_endo -52.79 -43.69 53.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.928 2.418 . . . . 0.0 112.693 -178.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 6.9 pt20 -56.98 -48.37 78.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.531 178.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.414 ' H ' ' HG3' ' A' ' 70' ' ' GLN . 3.8 mm-40 -59.61 -52.97 63.26 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.502 175.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.588 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 24.3 mt -60.38 -21.68 62.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.184 -166.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLN . . . . . 0.565 ' HG2' HD21 ' A' ' 145' ' ' LEU . 76.8 mt-30 -70.34 -46.2 64.62 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 174.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.9 tp -66.15 -22.36 66.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.831 172.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.588 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.1 t60 -66.98 -42.97 84.19 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.717 ' CD2' HG22 ' A' ' 100' ' ' VAL . 4.3 m-30 -70.32 -31.47 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 178.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.612 ' HD1' ' HE1' ' A' ' 141' ' ' PHE . 57.6 t80 -67.59 -53.28 29.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -80.62 -13.85 58.69 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.581 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.462 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.6 tpt -44.23 -40.0 4.84 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.752 0.821 . . . . 0.0 112.401 -170.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.671 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -146.49 10.41 1.09 Allowed 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.944 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.625 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.4 t70 -84.63 85.15 7.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.408 0.623 . . . . 0.0 109.764 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' TYR . . . . . 0.671 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 69.5 m-85 -104.14 -6.66 20.84 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.511 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 p30 -77.76 -13.86 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.203 0.525 . . . . 0.0 110.943 -178.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 67.34 26.86 73.47 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.554 -0.748 . . . . 0.0 113.161 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -99.98 -2.87 33.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 117.464 0.632 . . . . 0.0 110.462 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 63.12 31.89 15.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.349 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.547 HD22 ' HB2' ' A' ' 135' ' ' TYR . 15.8 mt -141.89 141.09 33.02 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.529 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.728 ' HB2' HG22 ' A' ' 136' ' ' ILE . 4.0 mm? -95.36 109.25 21.44 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -83.95 161.88 20.64 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.784 175.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.96 -48.5 24.85 Favored Glycine 0 C--O 1.23 -0.15 0 CA-C-O 119.782 -0.455 . . . . 0.0 113.842 -178.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.723 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.1 pp -68.48 -32.27 72.15 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 117.409 0.604 . . . . 0.0 111.592 -175.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.723 ' N ' HD12 ' A' ' 91' ' ' LEU . 50.4 mt-10 -71.25 -58.78 3.22 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.555 1.169 . . . . 0.0 108.272 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LEU . . . . . 1.118 ' HG ' HG12 ' A' ' 97' ' ' ILE . 12.3 tp -60.84 -11.5 7.96 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 112.897 -1.956 . . . . 0.0 111.466 -174.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.846 ' HA ' HD13 ' A' ' 121' ' ' ILE . 7.9 m -52.72 -32.28 42.13 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.448 0.699 . . . . 0.0 112.71 178.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.0 -35.2 15.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.958 178.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.714 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -75.36 -41.3 56.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.276 -170.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 1.118 HG12 ' HG ' ' A' ' 93' ' ' LEU . 26.8 mm -60.07 -19.89 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -174.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.692 HG23 HD21 ' A' ' 117' ' ' LEU . 4.4 m -55.25 -27.94 49.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.35 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 58.6 m-70 -107.93 -18.08 13.89 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.929 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.717 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.3 t -84.99 -53.52 10.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.531 -174.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 21.2 t60 . . . . . 0 C--O 1.235 0.323 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 178.778 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.561 ' HB1' HG22 ' A' ' 98' ' ' THR . . . . . . . . 0 CA--C 1.511 -0.521 0 N-CA-C 110.572 -0.158 . . . . 0.0 110.572 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -80.81 69.64 7.87 Favored 'Trans proline' 0 N--CA 1.441 -1.589 0 C-N-CA 121.795 1.663 . . . . 0.0 111.197 174.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.9 75.34 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.015 0.912 . . . . 0.0 110.734 171.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.402 ' HG2' ' H ' ' A' ' 112' ' ' MET . 12.8 ptt? -95.26 -58.01 2.25 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.04 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 13.7 m -160.99 127.24 3.93 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 176.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.594 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.72 -38.38 64.26 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.805 -178.011 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.504 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 20.7 t70 -64.8 -46.22 82.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.27 0.557 . . . . 0.0 110.861 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.57 -38.66 91.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.291 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.692 HD21 HG23 ' A' ' 98' ' ' THR . 6.7 tp -63.85 -32.12 73.53 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.309 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.594 HG13 ' O ' ' A' ' 114' ' ' GLU . 73.9 mt -59.36 -45.48 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.129 174.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -64.29 -38.17 90.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.3 0.572 . . . . 0.0 110.039 175.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . 0.547 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.3 mp -58.51 -46.67 89.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.068 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.846 HD13 ' HA ' ' A' ' 94' ' ' SER . 71.4 mt -62.9 -45.49 98.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 0.0 110.39 177.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . 0.517 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.6 t70 -57.77 -44.94 86.51 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.12 52.52 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.691 177.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' VAL . . . . . 0.944 HG21 HD12 ' A' ' 97' ' ' ILE . 46.2 t -65.3 -54.77 25.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.805 174.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.92 -7.25 26.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.193 0.52 . . . . 0.0 111.441 -176.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 9.9 mtt180 -107.74 -36.04 6.52 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.834 -178.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -127.12 -41.79 1.75 Allowed 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.54 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 1.3 m-20 -71.73 -18.47 62.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.497 0.665 . . . . 0.0 110.22 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . 0.596 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 2.2 t70 -77.81 93.12 4.29 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 165.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -79.09 -21.46 46.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.039 -169.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.63 -4.54 53.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -176.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ASN . . . . . 0.421 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 20.3 m120 61.25 34.78 18.52 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.379 -177.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -93.42 -15.16 25.93 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.767 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.3 -2.89 75.34 Favored Glycine 0 N--CA 1.453 -0.17 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.965 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' TYR . . . . . 0.547 ' HB2' HD22 ' A' ' 87' ' ' LEU . 45.5 m-85 -129.35 164.86 22.67 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 120.971 0.415 . . . . 0.0 110.005 178.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ILE . . . . . 0.728 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.4 tt -106.34 126.59 62.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.509 175.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.575 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 0.2 OUTLIER -103.23 178.96 4.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.304 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' TYR . . . . . 0.811 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.9 t80 -53.02 -48.02 67.88 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.363 0.414 . . . . 0.0 111.264 -176.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.65 -30.02 69.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.963 0.411 . . . . 0.0 111.491 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' GLU . . . . . 0.596 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.1 mt-10 -73.92 -50.79 18.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.251 -177.149 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' PHE . . . . . 0.811 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -74.7 -25.49 59.18 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.596 178.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.97 -43.03 91.31 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.129 0.49 . . . . 0.0 110.102 175.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' LYS . . . . . 0.421 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 34.5 mtmm -74.72 -28.44 60.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.745 176.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.2 t -78.55 -43.04 27.64 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.065 -171.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.565 HD21 ' HG2' ' A' ' 73' ' ' GLN . 2.8 pp . . . . . 0 N--CA 1.462 0.173 0 CA-C-O 120.943 0.401 . . . . 0.0 111.387 -175.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.622 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.3 mmm . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.655 0.264 . . . . 0.0 110.796 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.647 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 41.0 t -88.01 147.82 41.7 Favored Pre-proline 0 CA--C 1.536 0.418 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.175 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.66 -44.11 37.1 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 123.002 2.468 . . . . 0.0 114.125 -174.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.59 ' HA ' HE21 ' A' ' 73' ' ' GLN . 7.3 pt20 -56.81 -52.91 63.21 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.676 -177.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.647 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.1 pt-20 -73.1 -26.45 61.25 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.493 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.622 HD21 ' HB2' ' A' ' 67' ' ' MET . 18.0 mt -65.57 -17.68 64.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.717 0.294 . . . . 0.0 111.294 177.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.59 HE21 ' HA ' ' A' ' 70' ' ' GLN . 43.1 mt-30 -69.93 -47.28 63.01 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 172.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.2 tp -66.3 -19.64 65.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.582 174.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.545 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 26.6 t60 -68.19 -41.84 80.82 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.718 175.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.692 ' CD2' HG22 ' A' ' 100' ' ' VAL . 4.8 m-30 -66.49 -28.53 68.65 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 177.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.934 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 64.8 t80 -73.29 -53.87 9.77 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.649 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.481 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -79.62 -12.99 59.81 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.206 -175.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.403 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.1 tpt -44.52 -41.3 6.31 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 123.839 0.712 . . . . 0.0 111.901 -174.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.506 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -140.81 9.91 2.19 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.863 179.573 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.524 ' HB2' HD21 ' A' ' 88' ' ' LEU . 27.3 t70 -86.26 88.81 7.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.445 0.64 . . . . 0.0 110.268 178.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.506 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 21.7 m-85 -106.14 14.53 27.56 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.37 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -112.94 -15.41 12.88 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.319 -176.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 60.23 27.24 64.97 Favored Glycine 0 CA--C 1.525 0.666 0 CA-C-N 115.743 -0.662 . . . . 0.0 114.426 176.196 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 p-10 -89.3 3.33 52.48 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 117.766 0.783 . . . . 0.0 110.765 -178.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.934 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 2.6 t30 68.84 20.3 8.06 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.425 178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.534 HD22 ' HB2' ' A' ' 135' ' ' TYR . 40.8 mt -143.27 158.47 43.6 Favored 'General case' 0 C--O 1.245 0.861 0 CA-C-O 121.574 0.702 . . . . 0.0 111.248 179.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.589 HD11 ' HA ' ' A' ' 77' ' ' PHE . 70.6 mt -125.78 118.12 24.87 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.391 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -86.57 169.66 12.57 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 174.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.94 -35.69 54.16 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.403 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.5 mt -59.07 -42.8 91.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.262 0.553 . . . . 0.0 110.594 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.421 ' HA ' ' ND1' ' A' ' 80' ' ' HIS . 37.3 mt-10 -70.76 -50.59 34.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 122.035 0.921 . . . . 0.0 109.203 175.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 97' ' ' ILE . 29.4 mt -65.77 -12.22 52.17 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.733 -171.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.717 ' HA ' HD13 ' A' ' 121' ' ' ILE . 24.4 p -55.61 -31.95 62.7 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.545 0.212 . . . . 0.0 111.4 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.83 -36.82 14.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.234 0.54 . . . . 0.0 111.145 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.57 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.2 -43.91 20.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.744 -168.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.894 HD12 HG21 ' A' ' 124' ' ' VAL . 32.6 mm -62.82 -20.52 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.673 -174.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.713 HG23 HD21 ' A' ' 117' ' ' LEU . 17.5 m -56.39 -21.3 24.02 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.488 174.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -108.67 -44.5 4.04 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.207 174.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.692 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.9 t -59.16 -48.79 85.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.67 -173.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.47 ' CD2' HG13 ' A' ' 120' ' ' ILE . 27.8 t60 -80.59 76.53 7.44 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 120.422 -0.511 . . . . 0.0 109.765 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.559 ' HB2' ' O ' ' A' ' 105' ' ' GLY . 21.1 pttm -58.28 112.42 1.55 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.168 177.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -107.24 -74.52 0.66 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -106.88 46.71 0.91 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.139 0.495 . . . . 0.0 109.869 176.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 102' ' ' LYS . . . 179.61 178.27 48.32 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.054 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 17.0 m -106.42 -80.16 0.56 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.893 0.346 . . . . 0.0 110.704 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -96.66 -19.06 19.28 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-O 121.082 0.467 . . . . 0.0 110.851 176.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -73.31 135.2 44.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.733 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.602 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -70.23 114.35 25.03 Favored Pre-proline 0 CA--C 1.507 -0.695 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.096 177.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 3.4 Cg_exo -79.41 67.73 8.51 Favored 'Trans proline' 0 N--CA 1.439 -1.702 0 C-N-CA 121.496 1.464 . . . . 0.0 111.379 177.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 96.5 mt -58.71 83.47 0.01 OUTLIER 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.945 0.879 . . . . 0.0 110.779 171.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.456 ' H ' ' HG2' ' A' ' 112' ' ' MET . 12.8 ptt? -102.95 -54.24 2.67 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 114.335 -1.302 . . . . 0.0 110.837 -176.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.7 m -161.38 119.15 2.31 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.62 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.04 -40.67 67.29 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -174.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.466 ' HA ' HD12 ' A' ' 118' ' ' ILE . 33.9 m-20 -71.9 -40.67 68.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.793 0.33 . . . . 0.0 110.926 -178.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -63.89 -37.02 85.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.469 0.652 . . . . 0.0 109.357 173.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.713 HD21 HG23 ' A' ' 98' ' ' THR . 12.5 tp -65.93 -31.97 73.2 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.066 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 114' ' ' GLU . 88.1 mt -61.18 -45.19 99.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 120.895 0.379 . . . . 0.0 110.249 174.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -66.76 -31.79 72.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.844 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.571 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -62.31 -42.57 95.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.202 173.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.887 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.3 mt -64.59 -48.27 85.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.903 176.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.522 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 70.6 m-20 -50.81 -48.17 59.78 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 173.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.25 -28.42 34.66 Favored Glycine 0 C--O 1.224 -0.471 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.491 179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.894 HG21 HD12 ' A' ' 97' ' ' ILE . 54.9 t -72.08 -55.04 14.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 O-C-N 122.708 -0.289 . . . . 0.0 111.125 174.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.8 mp -65.92 -13.98 60.72 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.313 0.578 . . . . 0.0 111.044 -176.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 47.7 mtt180 -110.48 -29.59 8.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.265 -0.88 . . . . 0.0 111.881 -175.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -125.91 -46.44 1.69 Allowed 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -178.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.549 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 19.3 m-20 -68.06 -22.52 64.93 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 121.243 0.544 . . . . 0.0 110.275 -178.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.486 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 0.8 OUTLIER -76.09 99.53 4.67 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.313 -0.858 . . . . 0.0 108.818 168.626 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -80.75 -17.43 51.0 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.657 -171.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -98.88 -0.08 43.11 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 121.058 -0.257 . . . . 0.0 111.531 -173.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 11.6 m120 61.75 37.53 15.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.996 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -99.6 -19.62 16.76 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.52 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 85.87 6.54 82.35 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.436 178.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.534 ' HB2' HD22 ' A' ' 87' ' ' LEU . 50.9 m-85 -126.78 160.74 29.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.501 HG22 ' HB2' ' A' ' 88' ' ' LEU . 7.3 tt -110.86 117.39 54.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.082 0.944 . . . . 0.0 110.568 178.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -90.33 168.64 11.74 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.728 -1.123 . . . . 0.0 110.258 178.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.797 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 7.3 t80 -51.83 -47.24 64.43 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 110.536 -0.172 . . . . 0.0 110.536 -179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.37 -26.49 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.04 0.447 . . . . 0.0 110.984 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.486 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 44.2 mt-10 -76.12 -53.31 8.49 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.97 -177.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.797 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -72.49 -26.39 61.77 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 119.988 -0.685 . . . . 0.0 110.587 -179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.71 -42.42 97.19 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 109.857 -0.423 . . . . 0.0 109.857 174.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.428 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.5 mtmm -71.57 -28.92 64.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.781 176.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 23.1 t -80.21 -39.09 29.83 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.727 -172.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.637 HD12 HE21 ' A' ' 146' ' ' GLN . 4.3 pp -84.9 -15.12 45.61 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.991 -178.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.637 HE21 HD12 ' A' ' 145' ' ' LEU . 24.4 mm-40 . . . . . 0 C--O 1.246 0.904 0 CA-C-O 118.814 -0.612 . . . . 0.0 110.083 173.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.63 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.1 mmm . . . . . 0 N--CA 1.466 0.369 0 CA-C-O 120.653 0.263 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 m -91.74 156.58 42.67 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.858 -179.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.42 -50.75 12.82 Favored 'Trans proline' 0 N--CA 1.475 0.436 0 C-N-CA 122.85 2.367 . . . . 0.0 114.146 -173.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -62.45 -42.76 99.7 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.765 -174.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 17.5 pt-20 -77.6 -27.33 51.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.844 178.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.63 HD21 ' HB2' ' A' ' 67' ' ' MET . 13.5 mt -68.23 -17.96 64.44 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 120.745 0.307 . . . . 0.0 111.479 178.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.491 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 16.2 mt-30 -70.76 -45.74 64.21 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 107.432 -1.322 . . . . 0.0 107.432 171.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.3 tp -64.76 -20.62 66.46 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.641 173.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.525 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 62.3 t60 -68.7 -33.24 73.61 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.385 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.429 ' HD1' HG22 ' A' ' 100' ' ' VAL . 4.3 m-30 -72.12 -31.51 66.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 175.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.659 ' HB2' ' HZ ' ' A' ' 141' ' ' PHE . 47.6 t80 -69.03 -53.2 21.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.284 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.57 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.56 -10.4 59.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.678 -177.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.497 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 4.8 tpt -44.08 -39.43 4.21 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.904 0.881 . . . . 0.0 112.749 -171.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.518 ' O ' ' HG3' ' A' ' 92' ' ' GLU . 0.6 OUTLIER -144.74 10.21 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.344 -178.92 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.795 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.5 t70 -74.83 94.84 2.83 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.617 0.722 . . . . 0.0 110.819 -176.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -122.02 18.83 10.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.652 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 21.7 p30 -108.08 -13.67 14.89 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.844 -178.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 70.74 15.25 73.45 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.826 -0.625 . . . . 0.0 113.509 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.0 p-10 -95.13 -4.85 45.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.657 0.728 . . . . 0.0 111.012 -176.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.409 ' O ' HD22 ' A' ' 87' ' ' LEU . 47.2 m-80 62.69 19.76 11.6 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.691 177.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.537 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.4 mm? -129.14 163.31 25.79 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 172.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.656 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 86.9 mt -120.09 113.74 20.93 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 121.212 -0.195 . . . . 0.0 110.685 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.508 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 0.0 OUTLIER -86.25 175.66 8.35 Favored 'General case' 0 C--O 1.209 -1.059 0 O-C-N 123.794 0.684 . . . . 0.0 109.913 -178.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.44 -53.72 23.41 Favored Glycine 0 CA--C 1.518 0.232 0 N-CA-C 114.548 0.579 . . . . 0.0 114.548 -176.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.618 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.9 pp -80.33 -28.63 38.09 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 117.574 0.687 . . . . 0.0 111.573 -172.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.795 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 40.7 tt0 -70.54 -51.45 28.61 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.891 0.853 . . . . 0.0 108.866 173.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 1.025 ' HG ' HG12 ' A' ' 97' ' ' ILE . 17.1 tp -65.95 -12.57 55.81 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.018 -179.165 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.805 ' HA ' HD13 ' A' ' 121' ' ' ILE . 28.0 m -52.96 -31.89 42.99 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.906 -0.588 . . . . 0.0 112.187 178.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.3 m -87.71 -22.26 24.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.07 0.462 . . . . 0.0 111.287 -179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.795 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -93.08 -39.18 11.22 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -171.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 1.025 HG12 ' HG ' ' A' ' 93' ' ' LEU . 43.6 mm -64.83 -21.55 29.61 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-O 120.962 0.41 . . . . 0.0 110.777 -179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.866 HG23 HD21 ' A' ' 117' ' ' LEU . 3.4 m -57.9 -24.77 59.21 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.231 174.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -111.78 -27.55 8.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.986 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.769 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 40.5 t -61.7 -59.81 3.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 175.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 49.4 t60 -79.01 80.35 5.35 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 121.312 0.577 . . . . 0.0 110.11 174.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.541 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -79.94 123.16 27.55 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.344 175.284 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -85.49 -56.11 3.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.848 -175.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -123.02 46.55 2.15 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.12 0.486 . . . . 0.0 111.402 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.88 -161.19 26.8 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.845 -0.693 . . . . 0.0 111.464 179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 28.6 m -117.98 -47.32 2.6 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.376 0.608 . . . . 0.0 109.802 175.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.568 ' CD ' ' H ' ' A' ' 107' ' ' GLU . 0.0 OUTLIER -93.05 -39.39 11.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.144 -179.183 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -56.63 116.32 3.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.52 -1.218 . . . . 0.0 113.043 -171.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.865 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -71.19 116.11 43.53 Favored Pre-proline 0 CA--C 1.504 -0.812 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.968 172.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.461 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.2 Cg_endo -79.84 67.1 8.72 Favored 'Trans proline' 0 N--CA 1.438 -1.748 0 C-N-CA 121.343 1.362 . . . . 0.0 111.625 178.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.7 tp -63.21 78.97 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 122.144 0.973 . . . . 0.0 110.37 172.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.472 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.4 ptt? -97.76 -56.39 2.52 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 114.063 -1.426 . . . . 0.0 110.671 -177.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 52.0 m -155.62 119.31 4.45 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.439 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.8 pt-20 -56.9 -37.5 71.5 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.868 -170.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -67.53 -45.23 76.35 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.451 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.53 -39.43 94.4 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.265 176.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.866 HD21 HG23 ' A' ' 98' ' ' THR . 13.2 tp -62.23 -38.36 88.93 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.288 177.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 114' ' ' GLU . 76.5 mt -63.46 -41.88 94.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.509 174.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -67.26 -30.6 70.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.307 0.575 . . . . 0.0 110.16 175.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.425 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -63.36 -43.0 98.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.1 173.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.805 HD13 ' HA ' ' A' ' 94' ' ' SER . 82.0 mt -63.79 -47.35 91.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.646 176.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.722 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 0.5 OUTLIER -52.52 -47.74 66.47 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.363 176.216 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.19 -34.38 53.22 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 121.18 -0.533 . . . . 0.0 111.903 177.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 52.5 t -65.78 -52.07 54.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.621 0.248 . . . . 0.0 110.661 175.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.425 HD11 HD23 ' A' ' 93' ' ' LEU . 8.9 mp -67.74 -1.05 4.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.67 -177.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.722 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.9 mtm180 -118.2 -32.62 4.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.605 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -123.77 -45.51 2.03 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -176.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.526 ' HB2' HG13 ' A' ' 124' ' ' VAL . 4.4 m-20 -71.97 -17.05 62.09 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.132 0.492 . . . . 0.0 110.4 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.577 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.8 t70 -76.36 93.25 3.44 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 166.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.5 mmmt -79.37 -17.59 54.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.604 -168.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -114.45 8.07 16.42 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.244 -170.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.421 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 15.1 m120 61.02 36.2 18.62 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.984 174.433 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 22.7 p30 -98.38 -4.12 35.47 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.524 -0.47 . . . . 0.0 109.784 175.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.2 -16.27 23.86 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.986 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.537 ' HB2' HD12 ' A' ' 87' ' ' LEU . 16.5 m-85 -116.21 173.94 6.32 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 -178.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.543 HD13 ' HB3' ' A' ' 141' ' ' PHE . 7.1 tt -108.7 121.98 62.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.705 177.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -91.58 170.11 10.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.345 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.769 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 38.1 t80 -52.33 -48.77 65.28 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 123.113 0.258 . . . . 0.0 110.63 -178.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.6 -28.01 69.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.928 0.394 . . . . 0.0 111.686 -176.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.577 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 47.7 mt-10 -76.98 -49.21 15.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.481 -173.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.769 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -76.29 -27.99 56.83 Favored 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.534 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.44 -37.99 88.01 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 120.853 0.359 . . . . 0.0 110.553 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.412 ' HE3' ' HB2' ' A' ' 143' ' ' LYS . 47.6 mtmt -77.42 -29.01 52.79 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.527 175.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 21.7 t -75.58 -34.55 60.68 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.481 -175.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.4 pp -80.98 9.3 6.72 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.464 -178.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 . . . . . 0 C--O 1.246 0.89 0 CA-C-O 118.544 -0.741 . . . . 0.0 110.071 175.847 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.647 ' HB2' HD21 ' A' ' 72' ' ' LEU . 96.9 mmm . . . . . 0 N--CA 1.463 0.194 0 N-CA-C 110.257 -0.275 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.449 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 55.3 m -116.8 162.99 24.38 Favored Pre-proline 0 CA--C 1.539 0.531 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.241 178.389 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.451 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 81.1 Cg_exo -50.35 -49.33 16.76 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 123.284 2.656 . . . . 0.0 115.222 -172.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.403 ' HG3' ' OE1' ' A' ' 71' ' ' GLU . 3.3 pt20 -59.31 -48.68 80.73 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -172.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.449 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 1.7 pm0 -72.98 -28.65 62.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.707 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 67' ' ' MET . 27.6 mt -68.09 -17.62 64.43 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.166 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.451 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 28.7 mt-30 -69.59 -47.46 63.46 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 173.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 54.6 tp -65.91 -19.36 65.84 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.697 173.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.571 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 25.1 t60 -71.57 -42.29 68.0 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.908 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.793 ' CD2' HG22 ' A' ' 100' ' ' VAL . 7.4 m-30 -66.95 -29.09 68.86 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 178.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.557 ' HA ' HD11 ' A' ' 88' ' ' LEU . 58.0 t80 -73.01 -50.39 23.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.864 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.453 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.3 mmmt -80.94 -26.62 36.55 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -175.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 22.3 tpp -44.72 -53.94 6.79 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -170.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.469 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -122.54 9.18 9.6 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.438 -174.532 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.673 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.0 t70 -83.89 72.8 10.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.736 0.779 . . . . 0.0 109.554 178.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.423 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.8 OUTLIER -98.17 -7.02 30.21 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.067 -0.969 . . . . 0.0 110.915 -178.461 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 27.3 p30 -77.22 -13.65 59.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.8 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.3 24.06 74.19 Favored Glycine 0 N--CA 1.447 -0.587 0 CA-C-N 115.414 -0.812 . . . . 0.0 113.381 176.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.476 ' ND2' ' HB2' ' A' ' 87' ' ' LEU . 14.1 p-10 -104.57 -9.71 18.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 117.64 0.72 . . . . 0.0 111.719 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.8 m120 67.71 30.21 6.54 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.57 HD22 ' HB2' ' A' ' 135' ' ' TYR . 13.6 mt -138.47 163.95 30.63 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.298 -0.865 . . . . 0.0 108.939 172.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.557 HD11 ' HA ' ' A' ' 77' ' ' PHE . 84.2 mt -125.86 117.51 23.52 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 123.23 0.331 . . . . 0.0 110.974 -176.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.598 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.7 p30 -98.87 -170.28 1.91 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.317 177.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.12 -50.22 56.36 Favored Glycine 0 C--N 1.329 0.177 0 N-CA-C 114.32 0.488 . . . . 0.0 114.32 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.694 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.7 pp -75.0 -29.48 60.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.52 0.66 . . . . 0.0 110.749 -173.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.694 ' N ' HD12 ' A' ' 91' ' ' LEU . 47.9 mt-10 -68.8 -50.04 53.55 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.862 ' HB3' HG12 ' A' ' 97' ' ' ILE . 40.8 mt -66.82 -13.17 61.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.959 -178.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.649 ' HA ' HD13 ' A' ' 121' ' ' ILE . 48.4 m -57.39 -32.24 66.63 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.646 0.26 . . . . 0.0 111.321 179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.2 m -92.39 -33.45 14.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.371 0.605 . . . . 0.0 110.883 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.681 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.98 -51.08 8.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.091 -169.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.867 HD12 HG21 ' A' ' 124' ' ' VAL . 24.3 mm -57.66 -24.68 23.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.908 -174.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.637 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 4.2 m -58.4 -22.14 52.91 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.188 176.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.511 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 43.8 m-70 -106.67 -19.84 13.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.826 174.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.793 HG22 ' CD2' ' A' ' 76' ' ' TYR . 12.4 t -86.01 -60.14 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -170.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.43 ' CD2' HG13 ' A' ' 120' ' ' ILE . 74.1 t60 -51.2 125.79 14.95 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.373 0.42 . . . . 0.0 111.766 -170.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 144' ' ' SER . 23.7 ttmm -69.13 77.02 0.35 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.408 -0.815 . . . . 0.0 112.507 -173.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -113.46 -63.61 1.42 Allowed 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 165.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.776 ' HB2' ' HB3' ' A' ' 110' ' ' PRO . 36.4 mt-10 -132.08 28.76 4.43 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 167.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -102.35 122.39 7.51 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 114.74 -1.118 . . . . 0.0 113.211 -169.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 48.4 m -153.31 -67.9 0.15 Allowed 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 172.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -107.25 -52.08 2.82 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.682 167.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -71.62 155.94 39.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.562 -1.199 . . . . 0.0 112.113 -178.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.492 ' HB2' ' CE1' ' A' ' 99' ' ' HIS . . . -100.17 122.04 51.66 Favored Pre-proline 0 N--CA 1.447 -0.584 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.462 174.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.776 ' HB3' ' HB2' ' A' ' 104' ' ' GLU . 45.4 Cg_endo -71.02 63.94 2.53 Favored 'Trans proline' 0 N--CA 1.455 -0.735 0 C-N-CA 122.11 1.873 . . . . 0.0 111.769 170.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.5 mt -62.94 79.03 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.742 0.782 . . . . 0.0 111.299 174.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.405 ' H ' ' HG2' ' A' ' 112' ' ' MET . 18.3 ptt? -90.55 -59.16 2.25 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.67 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 75.4 m -167.36 129.93 1.68 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.335 -1.358 . . . . 0.0 107.335 177.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.596 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.4 OUTLIER -62.18 -28.26 69.54 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 123.264 0.352 . . . . 0.0 111.861 -175.028 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -70.71 -42.42 70.63 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -64.14 -40.71 96.74 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.506 HD11 ' HA ' ' A' ' 98' ' ' THR . 0.5 OUTLIER -62.76 -36.26 82.49 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 113.919 -1.492 . . . . 0.0 110.563 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.596 HG13 ' O ' ' A' ' 114' ' ' GLU . 68.6 mt -60.37 -43.48 93.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.904 0.383 . . . . 0.0 110.374 175.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -61.61 -38.32 87.19 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.606 0.717 . . . . 0.0 109.648 174.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.467 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -64.22 -39.99 87.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 114.794 -1.094 . . . . 0.0 111.3 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.805 ' HA ' HG21 ' A' ' 97' ' ' ILE . 79.2 mt -65.71 -41.82 91.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.466 178.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.767 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 27.1 t70 -62.94 -43.3 99.18 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.15 -30.39 57.66 Favored Glycine 0 C--O 1.224 -0.498 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.276 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 45.6 t -65.43 -49.28 79.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.747 0.308 . . . . 0.0 110.932 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 134' ' ' GLY . 96.2 mt -67.82 -9.89 48.23 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.995 0.426 . . . . 0.0 111.195 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.767 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.4 mtp85 -107.93 -34.78 6.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.308 -178.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -121.62 -47.31 2.22 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -171.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.539 ' HB2' HG13 ' A' ' 124' ' ' VAL . 15.1 m-20 -71.94 -21.11 61.65 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.058 0.456 . . . . 0.0 110.788 -177.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.537 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 5.2 t70 -76.66 91.44 3.44 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 168.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -78.43 -18.25 55.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.627 -167.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -117.25 16.02 14.87 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.789 -170.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 56.84 44.16 23.74 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.563 170.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -104.08 -15.46 15.56 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.692 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.407 ' O ' HD22 ' A' ' 125' ' ' LEU . . . 87.82 1.97 82.02 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.24 -0.505 . . . . 0.0 113.203 176.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.57 ' HB2' HD22 ' A' ' 87' ' ' LEU . 45.9 m-85 -132.74 170.88 14.62 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 175.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.499 HG22 HD21 ' A' ' 93' ' ' LEU . 7.1 tt -111.35 122.49 65.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.331 0.586 . . . . 0.0 109.739 174.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -103.3 -177.04 3.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.099 176.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.851 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.3 t80 -55.04 -48.99 72.7 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.551 0.532 . . . . 0.0 111.694 -171.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.17 -23.18 64.83 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.004 0.43 . . . . 0.0 111.464 -175.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.537 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 51.7 mt-10 -80.69 -53.11 6.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -174.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.851 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.8 p90 -68.88 -32.11 71.52 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.047 177.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -56.07 -41.87 75.77 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.998 0.428 . . . . 0.0 110.671 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.6 mtmm -72.72 -29.34 63.28 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.38 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.438 ' O ' ' HB2' ' A' ' 102' ' ' LYS . 9.0 t -79.84 -25.47 40.77 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -174.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.827 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 76.5 mt -79.96 -57.53 3.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.311 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 . . . . . 0 C--O 1.245 0.85 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.118 -177.751 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.652 ' HB2' HD21 ' A' ' 72' ' ' LEU . 93.5 mmm . . . . . 0 N--CA 1.464 0.229 0 CA-C-O 120.828 0.347 . . . . 0.0 110.908 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.545 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 5.8 m -85.53 153.83 58.84 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.874 177.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.604 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 18.9 Cg_endo -59.77 -26.96 83.8 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.463 2.775 . . . . 0.0 114.698 -169.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.436 ' HG3' ' H ' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -68.68 -54.92 13.35 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 121.421 0.629 . . . . 0.0 109.939 -177.155 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.545 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 1.7 pm0 -67.85 -27.04 66.35 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.249 174.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.751 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 15.1 mt -65.88 -20.62 66.29 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.403 177.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.768 ' HG2' HD13 ' A' ' 145' ' ' LEU . 20.8 mt-30 -72.22 -40.83 67.5 Favored 'General case' 0 C--N 1.313 -1.013 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 173.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.01 -24.38 65.11 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 172.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.751 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 18.0 t60 -68.92 -39.17 79.78 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.096 176.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.77 ' CD2' HG22 ' A' ' 100' ' ' VAL . 3.9 m-30 -66.94 -34.95 78.88 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.279 0.561 . . . . 0.0 109.813 175.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.54 ' HZ ' ' HA ' ' A' ' 86' ' ' ASN . 59.1 t80 -68.48 -53.35 23.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.24 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.405 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 28.0 mmmt -80.28 -12.33 59.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.61 -175.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.49 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.4 tpt -44.62 -38.89 4.59 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.928 0.768 . . . . 0.0 112.435 -172.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.622 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 1.0 OUTLIER -146.5 11.49 1.14 Allowed 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.293 -179.645 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.743 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 25.0 t70 -82.56 90.9 6.83 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.614 0.721 . . . . 0.0 110.326 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -105.01 -10.84 16.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.941 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 19.4 p30 -83.89 -13.7 52.92 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.606 -173.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 64.09 24.43 68.7 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.358 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -95.07 5.12 52.76 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 117.343 0.572 . . . . 0.0 111.018 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.54 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 19.6 m120 59.19 32.34 21.96 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.129 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 27.5 mt -151.31 160.14 43.95 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.63 178.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.602 ' HB2' HG22 ' A' ' 136' ' ' ILE . 60.7 mt -121.32 123.54 42.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.503 176.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.578 ' OD2' ' HG ' ' A' ' 91' ' ' LEU . 0.1 OUTLIER -92.37 177.81 6.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.583 176.71 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.27 -34.71 54.09 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.206 -179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.578 ' HG ' ' OD2' ' A' ' 89' ' ' ASP . 27.7 mt -71.08 -47.05 60.49 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.176 0.512 . . . . 0.0 110.099 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.743 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 50.6 mt-10 -62.45 -41.59 98.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.547 0.689 . . . . 0.0 109.586 174.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.677 ' HB3' HG12 ' A' ' 97' ' ' ILE . 34.1 mt -68.44 -15.03 63.4 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.166 -0.925 . . . . 0.0 112.744 -175.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.777 ' HA ' HD13 ' A' ' 121' ' ' ILE . 26.6 t -59.9 -32.48 70.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.074 0.464 . . . . 0.0 110.445 178.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 -30.26 17.78 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.393 0.616 . . . . 0.0 110.382 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.573 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -86.22 -55.49 3.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.969 -171.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.949 HD12 HG21 ' A' ' 124' ' ' VAL . 33.6 mm -59.03 -25.22 29.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 122.731 0.412 . . . . 0.0 111.793 -174.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.686 HG23 HD21 ' A' ' 117' ' ' LEU . 23.4 m -59.38 -16.06 20.6 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.219 0.533 . . . . 0.0 110.867 175.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 43.4 m-70 -110.77 -23.31 11.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.499 174.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.77 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.1 t -85.19 -45.9 17.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.731 -173.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.457 ' CD2' HG13 ' A' ' 120' ' ' ILE . 35.6 t60 -79.77 117.85 21.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 120.293 -0.563 . . . . 0.0 110.838 -176.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 106' ' ' SER . 94.2 mttt -72.37 152.95 41.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.511 178.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -162.64 -87.18 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -91.47 -35.0 14.58 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 171.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -107.44 -177.19 22.57 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 172.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.501 ' HA ' ' HG2' ' A' ' 102' ' ' LYS . 39.2 m -136.4 -37.27 0.7 Allowed 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 117.217 0.508 . . . . 0.0 111.023 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.53 ' HG2' ' N ' ' A' ' 108' ' ' GLN . 0.4 OUTLIER -105.35 -46.41 4.22 Favored 'General case' 0 N--CA 1.436 -1.143 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.092 175.223 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.53 ' N ' ' HG2' ' A' ' 107' ' ' GLU . 21.2 mt-30 -81.42 157.0 25.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.018 0.437 . . . . 0.0 111.403 -177.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.584 ' HA ' ' O ' ' A' ' 98' ' ' THR . . . -71.81 113.48 20.4 Favored Pre-proline 0 CA--C 1.506 -0.738 0 CA-C-N 115.023 -0.989 . . . . 0.0 110.311 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -85.06 69.36 5.69 Favored 'Trans proline' 0 N--CA 1.434 -1.98 0 C-N-CA 121.738 1.626 . . . . 0.0 110.711 176.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.8 mt -61.07 78.93 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.958 0.885 . . . . 0.0 111.04 174.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.486 ' H ' ' HG2' ' A' ' 112' ' ' MET . 11.6 ptt? -92.74 -56.97 2.81 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.314 -1.312 . . . . 0.0 110.474 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 55.9 m -158.61 125.76 4.89 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.421 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.52 -37.86 68.46 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.625 -0.716 . . . . 0.0 112.036 -176.546 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -60.24 -49.24 78.39 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.435 0.636 . . . . 0.0 110.11 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.13 -41.21 90.78 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.922 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.686 HD21 HG23 ' A' ' 98' ' ' THR . 8.1 tp -60.79 -39.69 89.82 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.561 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 114' ' ' GLU . 43.5 mt -59.01 -44.27 90.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.636 176.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -69.77 -31.61 69.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.645 177.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.457 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.2 mp -60.85 -46.5 96.16 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.125 174.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.912 ' HA ' HG21 ' A' ' 97' ' ' ILE . 83.9 mt -63.03 -47.26 93.54 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.251 177.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.808 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.8 t70 -60.5 -42.27 96.01 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.729 -179.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.49 -32.79 46.27 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.401 176.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.949 HG21 HD12 ' A' ' 97' ' ' ILE . 30.4 t -61.6 -51.1 76.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.7 0.286 . . . . 0.0 110.426 173.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.44 HD11 HD12 ' A' ' 93' ' ' LEU . 7.8 mp -66.54 -10.81 48.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.129 0.49 . . . . 0.0 110.993 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.808 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 25.8 mtp180 -99.67 -32.96 10.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.568 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -136.5 -43.28 0.61 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -171.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.653 ' HB3' HG13 ' A' ' 124' ' ' VAL . 32.0 t0 -72.95 -22.15 60.76 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.383 0.611 . . . . 0.0 110.554 -176.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.26 101.18 6.13 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 168.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.6 mmmt -78.42 -29.96 47.39 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.25 -168.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -86.02 -4.12 59.09 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.944 -174.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 59.11 36.43 24.1 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.741 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -96.81 -20.78 17.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.117 -176.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 106.24 -20.46 35.27 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.857 178.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -114.71 161.58 17.95 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-O 121.071 0.462 . . . . 0.0 110.554 -179.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.602 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.5 tt -107.04 125.88 63.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.411 175.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -104.13 -176.86 3.2 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.547 178.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.822 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 10.8 t80 -54.49 -43.66 71.97 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.441 0.463 . . . . 0.0 111.494 -174.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.82 -37.05 81.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.577 0.227 . . . . 0.0 111.227 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.48 ' OE1' ' HA ' ' A' ' 136' ' ' ILE . 50.7 mt-10 -71.45 -53.4 14.09 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.986 -171.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.822 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -70.04 -23.17 63.06 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.825 -178.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.611 ' HA ' HD12 ' A' ' 145' ' ' LEU . . . -79.65 -32.89 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.204 0.526 . . . . 0.0 110.496 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -69.55 -33.01 72.14 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.022 176.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.486 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 1.4 p -81.95 -30.57 31.66 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 109.179 -0.675 . . . . 0.0 109.179 178.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.768 HD13 ' HG2' ' A' ' 73' ' ' GLN . 6.7 mt -53.37 -45.62 69.3 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.149 170.673 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.929 -178.244 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.629 ' HB2' HD21 ' A' ' 72' ' ' LEU . 97.2 mmm . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 110.496 -0.187 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.473 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 20.3 m -93.54 158.23 37.14 Favored Pre-proline 0 CA--C 1.536 0.429 0 CA-C-N 116.662 -0.244 . . . . 0.0 110.912 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.541 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.4 Cg_exo -51.5 -45.68 36.18 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 123.129 2.552 . . . . 0.0 114.312 -173.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -57.24 -54.73 43.52 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.023 -173.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.473 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 3.6 pm0 -71.16 -33.3 69.9 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.88 177.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.656 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 13.9 mt -62.72 -21.06 65.51 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.319 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.803 ' HG2' HD21 ' A' ' 145' ' ' LEU . 16.5 mt-30 -67.17 -48.03 69.21 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 173.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.2 tp -64.04 -22.34 66.89 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.526 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.656 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 36.0 t60 -72.01 -43.24 65.36 Favored 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.131 178.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.562 ' CE2' HD22 ' A' ' 145' ' ' LEU . 5.3 m-30 -62.82 -32.97 74.27 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 176.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 32.5 t80 -70.96 -52.65 18.56 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 114.206 -1.361 . . . . 0.0 110.46 -178.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt -79.89 -21.31 44.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 120.724 -0.391 . . . . 0.0 111.717 -175.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 19.1 tpp -44.95 -52.99 8.17 Favored 'General case' 0 N--CA 1.471 0.586 0 O-C-N 123.796 0.685 . . . . 0.0 112.2 -173.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.672 ' HA ' ' CE2' ' A' ' 82' ' ' TYR . 1.8 m170 -122.94 9.88 9.44 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 120.468 -0.493 . . . . 0.0 112.008 -175.706 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.566 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 29.0 t70 -82.69 56.01 3.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.78 0.8 . . . . 0.0 109.917 -179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.672 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 47.5 m-85 -71.95 -23.97 61.53 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.713 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 32.8 p30 -71.83 -14.88 62.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.968 -1.015 . . . . 0.0 110.685 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.74 28.27 65.33 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.132 -0.94 . . . . 0.0 113.491 177.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -96.07 3.81 53.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 117.498 0.649 . . . . 0.0 111.775 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.491 ' HA ' ' CZ ' ' A' ' 77' ' ' PHE . 12.5 m120 65.61 25.18 11.66 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.216 0.532 . . . . 0.0 111.492 177.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.487 HD22 ' HB2' ' A' ' 135' ' ' TYR . 13.4 mt -147.19 156.5 43.02 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.682 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.621 ' HB2' HG22 ' A' ' 136' ' ' ILE . 75.8 mt -123.74 121.16 34.75 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.9 0.381 . . . . 0.0 111.536 -178.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.472 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 13.4 t70 -83.21 168.29 16.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.394 173.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.77 -36.51 55.21 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 121.308 -0.472 . . . . 0.0 112.609 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.472 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.4 mt -61.55 -43.31 99.09 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.491 0.662 . . . . 0.0 110.442 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.566 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.0 mt-10 -67.43 -46.53 72.88 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.959 0.885 . . . . 0.0 109.111 176.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.788 ' HB3' HG12 ' A' ' 97' ' ' ILE . 24.5 mt -66.61 -9.95 40.77 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.379 -173.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.693 ' HA ' HD13 ' A' ' 121' ' ' ILE . 36.2 t -54.4 -34.73 61.88 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.642 0.258 . . . . 0.0 111.301 179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m -91.19 -30.99 16.36 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.395 -0.522 . . . . 0.0 111.244 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.59 -46.07 14.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.828 -171.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.855 HG21 ' HA ' ' A' ' 121' ' ' ILE . 43.6 mm -65.16 -22.18 30.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.364 -175.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.69 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 11.2 m -62.73 -15.27 52.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 176.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.44 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 61.9 m-70 -114.91 -25.76 8.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.853 0.359 . . . . 0.0 110.32 174.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.707 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 58.7 t -66.3 -60.77 2.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.525 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 78.1 t60 -71.22 119.12 14.9 Favored 'General case' 0 C--O 1.233 0.237 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.908 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -75.44 122.22 23.48 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.495 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -140.2 -75.36 0.34 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.903 0.383 . . . . 0.0 109.991 178.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -111.81 17.11 20.11 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 122.029 0.918 . . . . 0.0 108.776 175.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.37 -169.42 40.55 Favored Glycine 0 N--CA 1.445 -0.72 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.949 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.2 m -155.51 -77.57 0.09 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -62.75 -47.79 81.99 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 175.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -82.99 144.91 29.65 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.513 -1.221 . . . . 0.0 108.773 173.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -81.99 119.51 75.31 Favored Pre-proline 0 CA--C 1.502 -0.882 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.41 -176.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.69 ' HD2' ' O ' ' A' ' 98' ' ' THR . 57.3 Cg_endo -74.99 71.73 4.89 Favored 'Trans proline' 0 N--CA 1.443 -1.466 0 C-N-CA 121.273 1.315 . . . . 0.0 111.82 174.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.67 76.15 0.02 OUTLIER 'General case' 0 N--CA 1.455 -0.18 0 CA-C-O 121.669 0.747 . . . . 0.0 110.623 170.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 22.5 ptt? -89.55 -59.23 2.27 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.56 -1.2 . . . . 0.0 110.398 -177.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.7 m -163.04 117.49 1.69 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.482 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -55.47 -35.29 65.36 Favored 'General case' 0 C--O 1.219 -0.504 0 O-C-N 123.739 0.649 . . . . 0.0 112.03 -174.27 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -65.15 -47.05 78.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.114 0.483 . . . . 0.0 110.53 -178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -68.9 -38.62 79.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.682 176.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.429 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.1 tm? -58.0 -39.62 78.71 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.947 177.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 114' ' ' GLU . 39.9 mt -60.6 -46.02 96.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.067 175.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 m-80 -64.7 -33.49 76.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.298 0.571 . . . . 0.0 110.209 177.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.3 mp -61.62 -47.92 91.12 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.437 175.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.855 ' HA ' HG21 ' A' ' 97' ' ' ILE . 70.4 mt -61.92 -43.96 98.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.64 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.653 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.6 t70 -63.08 -39.58 95.12 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.821 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.67 -28.84 60.51 Favored Glycine 0 N--CA 1.449 -0.491 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.911 177.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.826 HG21 HD12 ' A' ' 97' ' ' ILE . 45.5 t -61.8 -51.04 77.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.839 0.352 . . . . 0.0 110.918 174.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.38 -13.07 61.68 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.168 0.509 . . . . 0.0 110.9 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.653 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 17.6 mtm-85 -94.71 -50.06 5.33 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.626 -177.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -125.58 -31.61 2.96 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -173.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.549 ' CB ' ' HA ' ' A' ' 124' ' ' VAL . 9.6 t0 -75.14 -23.43 57.83 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.177 0.513 . . . . 0.0 110.637 -174.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.07 103.97 4.73 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 167.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -81.79 -18.66 43.33 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.417 -174.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . 0.486 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.1 m120 -83.3 -14.23 53.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.234 -172.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 131' ' ' ASN . 26.8 m-80 67.59 34.42 4.57 Favored 'General case' 0 N--CA 1.464 0.24 0 O-C-N 123.811 0.694 . . . . 0.0 110.365 -173.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.486 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -102.01 -21.36 14.49 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.8 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.27 4.61 77.29 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.466 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.487 ' HB2' HD22 ' A' ' 87' ' ' LEU . 59.6 m-85 -127.65 167.84 15.86 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 176.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.621 HG22 ' HB2' ' A' ' 88' ' ' LEU . 4.6 tt -107.86 122.69 62.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-O 121.93 0.872 . . . . 0.0 110.498 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -95.48 166.46 11.85 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.364 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.814 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 14.9 t80 -48.37 -47.68 37.21 Favored 'General case' 0 CA--C 1.523 -0.07 0 O-C-N 123.065 0.228 . . . . 0.0 110.869 -179.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.25 -39.93 95.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.386 -178.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.02 -50.27 64.82 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.89 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.814 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.2 p90 -74.03 -34.27 64.05 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 119.788 -0.765 . . . . 0.0 110.71 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.57 84.55 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-O 120.993 0.425 . . . . 0.0 110.239 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -72.2 -31.61 66.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.094 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 41.6 t -84.59 -37.04 21.63 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.367 -173.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.803 HD21 ' HG2' ' A' ' 73' ' ' GLN . 3.5 pp -80.54 -21.96 41.3 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.943 0.401 . . . . 0.0 110.963 -176.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.607 HE21 HD12 ' A' ' 145' ' ' LEU . 21.8 mm-40 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.393 -0.813 . . . . 0.0 110.363 178.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.514 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 97.6 mmm . . . . . 0 N--CA 1.463 0.2 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.812 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 2.9 p -95.46 170.04 8.37 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 119.664 -0.207 . . . . 0.0 110.939 179.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.812 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 33.6 Cg_endo -61.9 -37.77 63.55 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 122.356 2.037 . . . . 0.0 114.252 -164.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -54.55 45.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.226 0.536 . . . . 0.0 110.153 -174.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -76.46 -28.83 56.69 Favored 'General case' 0 C--O 1.219 -0.506 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.003 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.514 ' CD2' ' HB2' ' A' ' 67' ' ' MET . 12.1 mt -63.21 -19.81 64.86 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.653 179.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -71.75 -45.42 61.75 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.015 -1.105 . . . . 0.0 108.015 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 47.1 tp -64.37 -23.93 67.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.71 172.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.486 ' O ' ' HB2' ' A' ' 79' ' ' MET . 27.3 t60 -66.94 -39.78 87.39 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.081 -0.509 . . . . 0.0 109.787 176.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.841 ' HE1' HD21 ' A' ' 145' ' ' LEU . 5.2 m-30 -69.21 -25.65 64.42 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.264 0.554 . . . . 0.0 110.024 178.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.672 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 44.3 t80 -75.39 -54.23 7.4 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.819 177.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.672 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.9 mmmt -81.03 -17.38 50.43 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -173.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.486 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -45.74 -25.75 0.54 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 -174.103 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.816 ' HE1' HD23 ' A' ' 93' ' ' LEU . 0.2 OUTLIER -157.93 9.56 0.17 Allowed 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.003 -165.385 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.548 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 27.8 t70 -89.12 61.78 5.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.736 0.779 . . . . 0.0 109.627 -176.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.438 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 11.6 m-85 -76.44 -24.13 53.95 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.932 -178.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 18.6 p30 -70.34 -14.49 62.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.998 -174.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 63.13 28.14 71.67 Favored Glycine 0 N--CA 1.447 -0.607 0 CA-C-N 115.85 -0.614 . . . . 0.0 113.218 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 p-10 -96.76 -2.78 43.62 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 117.465 0.633 . . . . 0.0 110.396 179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 59.11 34.98 23.63 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.077 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.519 HD22 ' HB2' ' A' ' 135' ' ' TYR . 7.6 mt -150.9 155.87 40.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.403 177.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.605 ' HB2' HG22 ' A' ' 136' ' ' ILE . 2.3 mm? -114.48 112.04 22.35 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.687 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.567 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 12.7 t70 -82.9 161.98 21.7 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 173.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.5 ' HA2' ' HB2' ' A' ' 93' ' ' LEU . . . -54.93 -32.73 56.2 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.103 177.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.567 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 32.1 mt -59.73 -49.02 79.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.972 0.415 . . . . 0.0 110.31 178.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.548 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.6 mt-10 -63.28 -50.2 71.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.692 0.758 . . . . 0.0 109.15 173.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.816 HD23 ' HE1' ' A' ' 80' ' ' HIS . 46.2 mt -58.96 -15.11 11.35 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 114.548 -1.205 . . . . 0.0 113.432 -171.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.885 ' HA ' HD13 ' A' ' 121' ' ' ILE . 65.4 p -52.21 -33.68 42.19 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 123.294 0.371 . . . . 0.0 111.865 -178.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.39 -31.34 16.9 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.591 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -94.93 -33.51 12.75 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -170.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.815 HD12 HG21 ' A' ' 124' ' ' VAL . 31.1 mm -63.67 -18.08 21.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.28 0.562 . . . . 0.0 110.283 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.695 ' O ' ' HD2' ' A' ' 110' ' ' PRO . 2.6 m -60.01 -14.85 18.21 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.683 172.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -115.81 -39.99 3.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.852 174.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.706 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.6 t -60.54 -53.59 46.86 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.984 -175.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -76.3 71.1 2.98 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 172.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.636 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 1.6 pptp? -57.58 128.94 39.6 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.834 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -123.22 -63.45 1.25 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.874 -178.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.673 ' HG2' ' HB3' ' A' ' 110' ' ' PRO . 9.3 pt-20 -89.73 -31.77 17.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.769 0.318 . . . . 0.0 110.85 176.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.443 ' HA3' ' HG2' ' A' ' 108' ' ' GLN . . . -157.62 172.33 34.91 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 121.021 -0.609 . . . . 0.0 111.579 178.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 5.5 m -87.5 -55.22 3.89 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.619 0.21 . . . . 0.0 111.153 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -68.47 -56.51 8.16 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-O 121.271 0.558 . . . . 0.0 109.53 176.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.443 ' HG2' ' HA3' ' A' ' 105' ' ' GLY . 19.2 pt20 -60.72 154.27 22.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.682 -1.144 . . . . 0.0 111.799 -172.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -100.06 115.96 65.03 Favored Pre-proline 0 N--CA 1.443 -0.777 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.395 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.695 ' HD2' ' O ' ' A' ' 98' ' ' THR . 39.2 Cg_endo -69.86 60.58 1.74 Allowed 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.373 2.048 . . . . 0.0 111.665 172.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.49 77.53 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-O 121.931 0.872 . . . . 0.0 109.528 175.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.458 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.5 ptt? -83.52 -53.71 5.49 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 113.982 -1.463 . . . . 0.0 109.891 178.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 58.3 m -164.42 131.97 3.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 175.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.537 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.5 OUTLIER -61.85 -33.65 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.54 -173.695 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -70.51 -40.41 73.52 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 0.0 110.388 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -67.76 -37.72 82.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.157 0.503 . . . . 0.0 109.662 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.653 HD21 HG23 ' A' ' 98' ' ' THR . 9.4 tp -62.02 -42.06 98.76 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.149 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.7 mt -56.71 -41.64 75.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.932 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -72.49 -33.82 67.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.722 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.02 -36.34 76.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.424 177.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.885 HD13 ' HA ' ' A' ' 94' ' ' SER . 86.5 mt -65.26 -44.4 95.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.016 176.074 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.753 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 35.0 t70 -63.2 -36.82 84.89 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.02 -32.0 59.2 Favored Glycine 0 C--N 1.332 0.334 0 N-CA-C 111.655 -0.578 . . . . 0.0 111.655 174.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.815 HG21 HD12 ' A' ' 97' ' ' ILE . 49.5 t -64.76 -49.16 81.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-O 120.883 0.373 . . . . 0.0 110.154 173.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -65.52 -10.62 36.32 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.295 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.753 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 29.2 mtm180 -99.09 -48.3 4.91 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.482 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -118.91 -37.25 3.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.547 ' HB2' HG13 ' A' ' 124' ' ' VAL . 17.5 m-20 -75.15 -19.64 59.77 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.02 0.438 . . . . 0.0 110.869 -179.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.414 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 0.7 OUTLIER -79.45 94.23 5.52 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 167.281 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -79.47 -20.47 47.28 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.368 -172.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -82.68 -15.37 52.24 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.673 -175.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.414 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 13.8 m120 62.64 37.96 12.51 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.277 -171.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.0 p30 -103.98 -5.6 22.05 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.781 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 91.36 -18.84 50.49 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.932 -0.651 . . . . 0.0 113.109 174.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.519 ' HB2' HD22 ' A' ' 87' ' ' LEU . 29.3 m-85 -115.74 166.31 12.09 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 116.983 0.392 . . . . 0.0 110.367 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.605 HG22 ' HB2' ' A' ' 88' ' ' LEU . 8.5 tt -103.4 121.93 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 CA-C-O 121.855 0.836 . . . . 0.0 109.727 176.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -100.79 172.13 7.25 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.875 -1.057 . . . . 0.0 109.492 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.866 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 19.1 t80 -51.08 -47.37 61.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 123.28 0.363 . . . . 0.0 110.969 -178.276 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.16 -30.5 71.64 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.373 -179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -81.34 -50.82 9.04 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.819 -171.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.866 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -70.22 -34.55 73.03 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 119.623 -0.831 . . . . 0.0 110.832 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.501 ' HA ' HD12 ' A' ' 145' ' ' LEU . . . -68.07 -31.56 71.28 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.006 0.432 . . . . 0.0 110.465 179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -76.68 -27.9 55.74 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.04 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 17.0 t -78.5 -18.69 54.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.841 HD21 ' HE1' ' A' ' 76' ' ' TYR . 76.8 mt -86.82 -45.37 10.95 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.562 176.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.481 -0.771 . . . . 0.0 110.303 -178.261 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.63 ' HB2' HD21 ' A' ' 72' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.369 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.549 ' HB2' ' OE1' ' A' ' 71' ' ' GLU . 50.6 m -84.05 157.46 62.89 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.959 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.38 -45.66 36.07 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 123.101 2.534 . . . . 0.0 114.283 -172.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 4.0 pp0? -64.15 -43.59 94.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.821 -171.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.549 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 2.5 pm0 -77.06 -26.46 53.56 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.372 174.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.63 HD21 ' HB2' ' A' ' 67' ' ' MET . 13.2 mt -63.21 -21.53 66.28 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 178.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.511 ' HG2' HD21 ' A' ' 145' ' ' LEU . 24.6 mt-30 -68.89 -44.99 72.09 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 173.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 48.5 tp -67.49 -19.05 65.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.583 173.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.557 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 45.0 t60 -69.55 -34.15 73.8 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.373 -0.376 . . . . 0.0 109.992 175.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.706 ' CD2' HG22 ' A' ' 100' ' ' VAL . 5.1 m-30 -72.06 -27.83 62.94 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.568 ' O ' HD11 ' A' ' 88' ' ' LEU . 34.6 t80 -73.69 -52.66 12.52 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.738 176.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.55 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.9 mmmt -80.28 -13.03 59.53 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -175.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.461 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 2.2 tpt -45.57 -38.26 6.29 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.173 0.589 . . . . 0.0 112.285 -173.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.413 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -143.04 11.14 1.77 Allowed 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.041 -178.495 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.745 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 35.1 t70 -79.74 84.33 5.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.648 0.737 . . . . 0.0 110.557 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -119.02 22.59 11.83 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.183 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.7 p30 -110.86 -14.11 14.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.769 -174.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 68.79 25.9 74.9 Favored Glycine 0 N--CA 1.448 -0.528 0 CA-C-N 116.079 -0.51 . . . . 0.0 113.107 -179.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -101.03 -1.95 32.92 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 117.46 0.63 . . . . 0.0 111.371 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 63.21 27.33 15.53 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.172 176.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.608 HD22 ' HB2' ' A' ' 135' ' ' TYR . 15.5 mt -153.27 167.61 28.76 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.461 179.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.568 HD11 ' O ' ' A' ' 77' ' ' PHE . 3.0 mm? -124.39 121.81 35.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.356 -179.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.568 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.2 p-10 -104.52 -179.25 3.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.83 -36.79 33.91 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 114.201 0.44 . . . . 0.0 114.201 -177.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.568 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 30.8 mt -64.3 -53.44 48.8 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.321 0.582 . . . . 0.0 110.552 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.745 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 41.6 mt-10 -62.95 -47.98 80.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.916 178.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.818 ' HB3' HG12 ' A' ' 97' ' ' ILE . 37.9 mt -66.23 -10.68 44.19 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.98 -174.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.974 ' HA ' HD13 ' A' ' 121' ' ' ILE . 24.0 t -56.4 -34.52 66.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.734 0.302 . . . . 0.0 110.845 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.9 m -92.22 -28.57 16.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.239 0.542 . . . . 0.0 111.569 177.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.538 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -83.72 -47.13 11.5 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.739 -171.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.892 HD12 HG21 ' A' ' 124' ' ' VAL . 33.8 mm -60.14 -20.84 20.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.383 -175.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.827 HG22 ' HB1' ' A' ' 109' ' ' ALA . 8.9 m -51.02 -30.55 15.61 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.971 174.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.472 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 68.5 m-70 -103.82 -33.07 9.02 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.687 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.706 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.5 t -68.06 -51.74 45.89 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.478 -173.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -74.67 89.11 2.23 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 2.7 pptp? -103.25 154.98 18.78 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -165.58 -46.91 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.167 175.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 45.5 mm-40 -95.49 42.28 1.09 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.861 173.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.36 -144.7 6.25 Favored Glycine 0 N--CA 1.446 -0.681 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 -177.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 2.9 t -146.19 -78.84 0.17 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -115.07 0.5 13.64 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 122.293 1.044 . . . . 0.0 109.701 174.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -89.74 150.29 22.37 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.598 -1.183 . . . . 0.0 109.399 178.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.827 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -83.19 117.34 68.3 Favored Pre-proline 0 CA--C 1.508 -0.654 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.978 -176.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.11 63.3 8.21 Favored 'Trans proline' 0 N--CA 1.445 -1.36 0 C-N-CA 121.886 1.724 . . . . 0.0 111.05 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.4 89.63 0.01 OUTLIER 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.837 0.827 . . . . 0.0 111.402 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.431 ' HG3' ' H ' ' A' ' 113' ' ' SER . 13.2 ptt? -93.48 -59.06 2.1 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.001 178.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.431 ' H ' ' HG3' ' A' ' 112' ' ' MET . 74.9 m -164.63 123.93 1.88 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 178.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.625 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.1 OUTLIER -54.04 -34.97 61.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.87 -174.788 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.465 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 21.2 t70 -71.36 -42.68 68.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.948 0.404 . . . . 0.0 110.666 -178.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.02 -38.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.859 0.838 . . . . 0.0 108.93 173.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.679 HD21 HG23 ' A' ' 98' ' ' THR . 9.5 tp -61.25 -37.1 81.88 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.333 177.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.625 HG13 ' O ' ' A' ' 114' ' ' GLU . 82.0 mt -57.13 -43.7 81.94 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.474 175.484 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 35.9 m-20 -65.49 -39.29 91.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.464 0.65 . . . . 0.0 109.607 176.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -61.46 -41.44 90.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.008 -0.996 . . . . 0.0 111.171 178.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.974 HD13 ' HA ' ' A' ' 94' ' ' SER . 90.1 mt -65.26 -38.58 82.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.953 178.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.796 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 32.8 t70 -63.7 -42.14 98.02 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.35 -32.0 57.25 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.368 176.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.892 HG21 HD12 ' A' ' 97' ' ' ILE . 46.5 t -61.82 -47.88 91.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.949 0.404 . . . . 0.0 110.215 174.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 66.3 mt -67.61 -7.45 26.56 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.82 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.796 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 22.5 mtp85 -103.48 -47.21 4.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.744 -178.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -112.7 -48.83 2.98 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -175.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.6 ' HB2' HG13 ' A' ' 124' ' ' VAL . 20.9 m-20 -68.84 -22.37 64.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.025 0.441 . . . . 0.0 111.123 -174.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.595 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 6.1 t70 -76.35 80.3 3.1 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.55 -17.96 63.61 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 114.649 -1.159 . . . . 0.0 111.844 -169.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -116.85 10.23 14.1 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.928 -172.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.595 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 17.9 m120 53.63 44.63 29.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.159 -0.928 . . . . 0.0 112.579 173.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.3 p30 -99.13 -13.09 19.94 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.199 176.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.02 4.17 78.69 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.128 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.608 ' HB2' HD22 ' A' ' 87' ' ' LEU . 34.4 m-85 -133.65 176.68 8.33 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.427 HG23 ' HD1' ' A' ' 141' ' ' PHE . 8.3 tt -117.6 119.62 62.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-O 121.359 0.6 . . . . 0.0 109.73 175.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -97.53 -178.67 4.21 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.823 177.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.763 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.5 t80 -56.03 -47.92 76.93 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 123.44 0.463 . . . . 0.0 111.058 -173.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.05 -27.99 66.99 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.959 0.409 . . . . 0.0 111.548 -176.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.575 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 50.9 mt-10 -74.27 -53.87 8.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.849 -177.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.763 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.8 p90 -72.84 -28.83 62.76 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.876 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -62.06 -36.39 81.48 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 120.822 0.344 . . . . 0.0 110.393 177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -73.91 -32.16 63.42 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.38 -0.528 . . . . 0.0 111.025 176.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.453 ' HB3' HG12 ' A' ' 100' ' ' VAL . 9.0 t -81.3 -38.81 26.19 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.039 -171.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.579 HD12 HE21 ' A' ' 146' ' ' GLN . 4.3 pp -82.58 -13.01 57.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.646 -175.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.579 HE21 HD12 ' A' ' 145' ' ' LEU . 22.6 mm-40 . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.862 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.526 ' HB2' HD21 ' A' ' 72' ' ' LEU . 95.9 mmm . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.664 0.269 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.446 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 9.0 m -82.4 157.74 67.32 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.428 -178.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.551 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 75.0 Cg_exo -50.76 -48.94 18.43 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.902 2.401 . . . . 0.0 114.255 -173.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -59.92 -49.5 77.43 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -174.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.446 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 5.3 pm0 -71.7 -28.92 64.03 Favored 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 120.923 -0.311 . . . . 0.0 110.737 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.526 HD21 ' HB2' ' A' ' 67' ' ' MET . 11.3 mt -64.27 -21.28 66.53 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.371 179.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 24.1 mt-30 -69.57 -46.31 66.68 Favored 'General case' 0 C--N 1.31 -1.139 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 49.1 tp -65.15 -20.91 66.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.896 173.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.503 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 48.8 t60 -69.67 -43.3 72.81 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.404 ' N ' ' CD1' ' A' ' 76' ' ' TYR . 4.2 m-30 -65.69 -25.16 67.19 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.618 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 45.1 t80 -75.6 -53.56 8.4 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.039 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.618 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.3 mmmt -79.9 -30.88 40.22 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -173.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 17.3 tpp -47.93 -36.29 12.14 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.402 0.89 . . . . 0.0 113.402 -170.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.832 ' HE1' HD23 ' A' ' 93' ' ' LEU . 0.3 OUTLIER -135.2 8.37 3.43 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -169.015 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.667 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.0 t70 -88.51 73.03 8.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 122.016 0.913 . . . . 0.0 109.354 177.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -72.08 -22.37 61.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.313 -175.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -87.06 -15.89 37.24 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.533 -175.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.418 ' HA2' ' OD1' ' A' ' 81' ' ' ASP . . . 62.58 29.69 74.35 Favored Glycine 0 CA--C 1.522 0.509 0 CA-C-N 115.545 -0.752 . . . . 0.0 114.401 175.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -94.19 6.87 47.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 117.783 0.791 . . . . 0.0 111.464 -178.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 69.79 13.65 8.06 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.839 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.546 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.2 mm? -131.16 152.44 50.44 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-O 121.09 0.472 . . . . 0.0 110.309 175.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.681 HD22 ' CD2' ' A' ' 80' ' ' HIS . 14.5 mt -119.94 109.16 15.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.612 -179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.618 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 11.1 t70 -75.3 160.93 29.76 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.502 ' HA2' ' HB2' ' A' ' 93' ' ' LEU . . . -53.4 -29.5 38.64 Favored Glycine 0 N--CA 1.464 0.53 0 C-N-CA 121.29 -0.481 . . . . 0.0 112.386 174.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.618 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 47.8 mt -60.35 -55.26 35.82 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.047 0.451 . . . . 0.0 110.085 175.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.667 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 34.7 mt-10 -59.37 -53.02 62.99 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.207 174.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.832 HD23 ' HE1' ' A' ' 80' ' ' HIS . 69.1 mt -55.59 -17.07 4.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.897 -172.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.902 ' HA ' HD13 ' A' ' 121' ' ' ILE . 15.8 t -52.48 -32.01 37.83 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 123.362 0.414 . . . . 0.0 111.912 -177.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 -29.4 17.43 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.533 ' HB3' ' CE1' ' A' ' 80' ' ' HIS . . . -98.13 -28.07 13.9 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -168.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.723 ' CG1' ' HB3' ' A' ' 93' ' ' LEU . 34.5 mm -66.52 -17.08 21.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.671 0.748 . . . . 0.0 110.064 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.812 HG23 HD21 ' A' ' 117' ' ' LEU . 5.6 m -63.22 -17.2 62.18 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.735 172.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.58 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 98.9 m-70 -112.46 -21.41 11.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.074 0.464 . . . . 0.0 110.088 174.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.691 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.1 t -77.76 -59.39 3.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.149 -179.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.54 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.4 t60 -80.09 74.05 6.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.399 0.619 . . . . 0.0 109.811 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.611 ' HB2' ' O ' ' A' ' 105' ' ' GLY . 10.1 ptmm? -58.91 153.48 17.23 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.662 -1.154 . . . . 0.0 113.152 -176.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -142.12 -76.41 0.28 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.62 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.827 ' HG2' ' HB3' ' A' ' 110' ' ' PRO . 7.5 pt-20 -67.64 -44.46 77.89 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 121.172 0.51 . . . . 0.0 110.444 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.611 ' O ' ' HB2' ' A' ' 102' ' ' LYS . . . -130.91 -155.27 8.17 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 175.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 3.3 p -97.06 -84.48 0.37 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 117.327 0.563 . . . . 0.0 111.139 177.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 9.2 mp0 -76.71 -22.29 54.1 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 120.814 0.34 . . . . 0.0 111.523 -177.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -69.84 127.11 31.75 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.928 0.394 . . . . 0.0 110.679 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.58 ' HB2' ' CE1' ' A' ' 99' ' ' HIS . . . -66.98 117.85 49.67 Favored Pre-proline 0 CA--C 1.504 -0.815 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.791 -176.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.827 ' HB3' ' HG2' ' A' ' 104' ' ' GLU . 1.1 Cg_endo -83.34 68.73 7.14 Favored 'Trans proline' 0 N--CA 1.432 -2.089 0 C-N-CA 121.708 1.605 . . . . 0.0 111.287 175.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 35.1 tp -66.07 74.67 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.049 0.928 . . . . 0.0 110.28 173.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.484 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.3 ptt? -90.88 -50.75 5.71 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.97 -1.468 . . . . 0.0 110.597 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.3 m -159.4 125.45 4.37 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.537 ' O ' HG13 ' A' ' 118' ' ' ILE . 11.5 pt-20 -57.14 -41.88 79.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.391 -176.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -66.34 -50.28 64.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.979 0.418 . . . . 0.0 110.286 -178.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.05 -41.32 78.46 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.245 175.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.812 HD21 HG23 ' A' ' 98' ' ' THR . 9.0 tp -63.76 -36.95 85.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.704 178.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.537 HG13 ' O ' ' A' ' 114' ' ' GLU . 87.6 mt -60.57 -44.0 95.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.231 174.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -66.47 -32.26 73.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.047 0.451 . . . . 0.0 110.459 175.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.54 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.64 -39.01 78.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.572 174.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.902 HD13 ' HA ' ' A' ' 94' ' ' SER . 46.3 mt -74.98 -19.26 16.35 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 CA-C-O 121.191 0.519 . . . . 0.0 110.591 177.506 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.687 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 30.2 t70 -74.11 -41.08 62.18 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 173.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.6 -35.92 63.31 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 114.588 -1.187 . . . . 0.0 113.211 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.836 HG13 HD12 ' A' ' 125' ' ' LEU . 7.2 p -62.56 -47.17 94.24 Favored 'Isoleucine or valine' 0 C--O 1.231 0.089 0 CA-C-N 117.529 0.664 . . . . 0.0 110.533 178.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.836 HD12 HG13 ' A' ' 124' ' ' VAL . 5.4 mp -70.44 -11.81 61.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.847 0.356 . . . . 0.0 111.379 -179.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.687 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 20.2 mtm180 -92.92 -49.28 6.12 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -125.8 -26.8 3.43 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -169.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.67 ' HB2' HG23 ' A' ' 124' ' ' VAL . 41.8 m-20 -79.14 -28.47 42.83 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 120.499 -0.481 . . . . 0.0 110.685 -178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -75.5 96.41 3.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.578 0.704 . . . . 0.0 109.367 171.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -80.85 -18.75 46.36 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.768 -174.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -78.58 -15.76 58.19 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.062 0.458 . . . . 0.0 110.16 -176.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 66.0 t30 59.67 33.28 21.88 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.601 -173.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -97.88 -16.8 19.6 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.275 -178.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 108.69 -34.62 5.46 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.687 178.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.546 ' HB2' HD12 ' A' ' 87' ' ' LEU . 6.9 m-85 -114.73 168.84 9.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 117.46 0.63 . . . . 0.0 111.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.668 HG22 HD12 ' A' ' 88' ' ' LEU . 0.2 OUTLIER -95.59 127.48 47.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.333 -179.8 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.95 -176.44 3.08 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.255 169.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.797 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.3 t80 -55.4 -48.09 74.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.569 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -65.22 -27.35 68.61 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.502 ' OE2' ' HA ' ' A' ' 136' ' ' ILE . 56.6 mt-10 -81.66 -47.93 12.36 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.79 -173.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.797 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.1 p90 -71.13 -30.44 66.5 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 119.293 -0.963 . . . . 0.0 109.494 176.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.32 -46.27 86.47 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.514 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 48.8 mtmt -77.46 -29.15 52.62 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.618 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 22.7 t -80.11 -33.94 38.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.398 -172.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.54 HD12 HE21 ' A' ' 146' ' ' GLN . 4.5 pp -79.2 -5.11 53.51 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.842 0.353 . . . . 0.0 111.41 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.54 HE21 HD12 ' A' ' 145' ' ' LEU . 19.1 mm-40 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 118.51 -0.757 . . . . 0.0 111.274 -177.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.767 ' HB2' HD11 ' A' ' 72' ' ' LEU . 93.0 mmm . . . . . 0 C--O 1.232 0.149 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.425 ' O ' HD13 ' A' ' 72' ' ' LEU . 16.2 m -83.32 155.52 66.46 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.747 179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.41 -41.36 43.63 Favored 'Trans proline' 0 C--O 1.237 0.472 0 C-N-CA 123.022 2.481 . . . . 0.0 114.152 -172.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 73' ' ' GLN . 12.2 pt20 -57.56 -39.67 77.2 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.039 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.415 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 4.4 mm-40 -67.72 -44.83 76.72 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 175.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.84 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 10.0 mp -61.29 -21.85 64.32 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.075 -168.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.41 ' NE2' ' HA ' ' A' ' 70' ' ' GLN . 18.5 mt-30 -62.85 -49.68 73.91 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 174.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HG ' ' HG2' ' A' ' 78' ' ' LYS . 28.1 tp -68.03 -24.31 65.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.911 174.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.84 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.4 t60 -67.07 -41.54 86.25 Favored 'General case' 0 C--O 1.225 -0.198 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.733 ' CD1' HG22 ' A' ' 100' ' ' VAL . 4.4 m-30 -72.4 -38.04 68.53 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.634 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.621 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 51.8 t80 -63.66 -51.55 64.62 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.69 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.614 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 23.7 mmmt -79.01 -19.12 52.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.2 -174.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 16.8 tpp -44.16 -50.44 8.67 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.954 0.784 . . . . 0.0 112.203 -173.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -130.0 9.97 5.39 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.414 -0.515 . . . . 0.0 111.549 -178.278 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.699 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.3 t70 -82.46 72.19 9.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.689 0.757 . . . . 0.0 110.09 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -105.1 13.58 30.55 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 114.73 -1.123 . . . . 0.0 110.059 178.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.1 p30 -101.65 -13.71 17.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.835 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 65.18 32.0 82.48 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.561 -0.745 . . . . 0.0 113.3 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -107.52 -4.54 18.3 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.597 0.698 . . . . 0.0 111.763 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.1 m120 68.37 12.31 8.68 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.027 0.531 . . . . 0.0 112.255 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.564 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -128.54 164.71 22.22 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.562 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 65.7 mt -126.32 119.26 26.9 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.235 174.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.49 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.3 p30 -99.0 -176.72 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 175.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.21 -36.6 52.86 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 121.594 -0.336 . . . . 0.0 113.758 -175.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.49 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 46.4 mt -63.52 -47.24 82.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.178 0.513 . . . . 0.0 110.29 -177.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.699 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 36.6 mt-10 -69.12 -49.95 52.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.742 176.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.797 ' HB3' HG12 ' A' ' 97' ' ' ILE . 35.1 mt -63.94 -14.7 55.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.718 -1.128 . . . . 0.0 113.263 -173.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.779 ' HA ' HD13 ' A' ' 121' ' ' ILE . 79.7 p -56.51 -37.54 70.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 120.859 0.361 . . . . 0.0 111.008 -178.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -91.71 -27.15 18.25 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.348 0.594 . . . . 0.0 111.141 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.627 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -82.27 -48.51 11.13 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.605 -172.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.933 HG21 ' HA ' ' A' ' 121' ' ' ILE . 30.4 mm -59.66 -25.75 32.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.954 -174.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.694 HG23 HD21 ' A' ' 117' ' ' LEU . 20.9 m -55.94 -22.23 25.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.132 174.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.522 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 90.4 m-70 -110.8 -11.43 14.38 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.499 177.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.733 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.7 t -95.1 -49.42 12.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -175.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.575 ' CD2' HG13 ' A' ' 120' ' ' ILE . 69.8 t60 -73.31 98.54 2.7 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.308 -174.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.459 ' HD2' ' O ' ' A' ' 144' ' ' SER . 0.0 OUTLIER -59.12 134.17 56.75 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.654 171.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -162.14 -74.79 0.05 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -88.58 -57.71 2.82 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 169.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -100.06 -157.57 28.25 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 110.363 -1.095 . . . . 0.0 110.363 170.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.434 ' HB2' ' OE1' ' A' ' 107' ' ' GLU . 10.8 m -139.37 -84.99 0.24 Allowed 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 117.147 0.474 . . . . 0.0 109.863 176.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.434 ' OE1' ' HB2' ' A' ' 106' ' ' SER . 2.7 mp0 -70.55 -49.81 44.11 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.424 0.63 . . . . 0.0 109.979 175.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 83.9 mm-40 -68.84 140.17 55.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.741 178.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.658 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -75.48 117.48 63.65 Favored Pre-proline 0 CA--C 1.503 -0.849 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.904 -173.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -84.03 68.95 6.58 Favored 'Trans proline' 0 N--CA 1.431 -2.153 0 C-N-CA 121.288 1.326 . . . . 0.0 111.241 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 95.0 mt -59.63 80.23 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-O 122.115 0.96 . . . . 0.0 110.782 172.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.483 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.1 ptt? -92.86 -58.03 2.46 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.315 -178.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 70.9 m -159.68 122.11 3.43 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 177.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.609 ' O ' HG13 ' A' ' 118' ' ' ILE . 5.0 pm0 -56.44 -34.16 66.56 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 -170.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -74.08 -35.23 64.22 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.204 -0.598 . . . . 0.0 110.135 -178.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -68.63 -39.21 80.87 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 173.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.694 HD21 HG23 ' A' ' 98' ' ' THR . 11.6 tp -59.92 -39.02 84.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.296 177.41 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.609 HG13 ' O ' ' A' ' 114' ' ' GLU . 95.9 mt -61.22 -44.86 99.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.742 175.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -65.65 -32.88 74.7 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 109.987 177.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.575 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -59.49 -38.68 76.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.537 175.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.933 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -68.42 -39.6 81.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.411 177.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.731 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.5 t70 -61.99 -44.85 95.86 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.119 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.11 -34.4 52.76 Favored Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.466 176.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.813 HG21 HD12 ' A' ' 97' ' ' ILE . 47.3 t -65.04 -48.35 84.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.86 0.362 . . . . 0.0 110.414 175.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.447 HD22 ' O ' ' A' ' 134' ' ' GLY . 88.1 mt -67.87 -4.88 14.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.08 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.731 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.4 mtm180 -103.29 -49.21 3.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -120.21 -35.41 3.45 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.656 ' HB2' HG13 ' A' ' 124' ' ' VAL . 26.3 m-20 -78.23 -16.7 57.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.153 0.501 . . . . 0.0 110.288 -179.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -76.74 90.85 3.44 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 166.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.42 -17.04 59.55 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.731 -167.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -119.94 17.95 12.52 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 54.71 40.23 31.78 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.442 172.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.6 p30 -102.53 -11.49 18.49 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.261 177.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.447 ' O ' HD22 ' A' ' 125' ' ' LEU . . . 84.16 1.15 89.63 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.617 177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.564 ' HB2' HD12 ' A' ' 87' ' ' LEU . 13.8 m-85 -127.59 178.86 5.83 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.535 HG22 HD21 ' A' ' 93' ' ' LEU . 3.7 tt -121.41 125.53 73.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 173.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -103.14 -177.62 3.43 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.104 176.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.888 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 15.2 t80 -56.66 -48.82 76.76 Favored 'General case' 0 C--O 1.227 -0.128 0 O-C-N 123.3 0.375 . . . . 0.0 110.838 -175.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.19 -21.91 64.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.694 0.283 . . . . 0.0 111.558 -176.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -78.52 -56.78 4.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.888 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -67.63 -32.08 72.54 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.855 -0.738 . . . . 0.0 110.097 178.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.61 -39.95 78.04 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 120.953 0.406 . . . . 0.0 110.421 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.423 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 33.3 mtmm -75.34 -28.11 59.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.961 176.271 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.459 ' O ' ' HD2' ' A' ' 102' ' ' LYS . 23.2 t -79.21 -19.01 51.86 Favored 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.82 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 68.3 mt -87.12 8.55 23.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.415 178.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.227 -179.607 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.493 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 98.9 mmm . . . . . 0 N--CA 1.464 0.24 0 CA-C-O 121.142 0.496 . . . . 0.0 111.732 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.545 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 17.2 m -93.16 163.41 25.24 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.742 -178.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.578 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.6 Cg_exo -53.34 -49.92 15.76 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 122.809 2.339 . . . . 0.0 113.969 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.53 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 2.1 pt20 -61.77 -49.94 74.38 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.068 -176.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 68' ' ' SER . 0.8 OUTLIER -61.27 -43.34 99.03 Favored 'General case' 0 CA--C 1.504 -0.827 0 C-N-CA 120.977 -0.289 . . . . 0.0 110.675 175.077 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.55 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 12.3 mt -62.44 -22.85 66.52 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.702 -173.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.838 ' HG2' HD21 ' A' ' 145' ' ' LEU . 21.1 mt-30 -71.3 -39.67 71.32 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 175.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 50.7 tp -67.51 -24.67 65.59 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.384 171.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.55 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 59.3 t60 -65.88 -46.43 78.43 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 175.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.458 ' CD1' HD22 ' A' ' 145' ' ' LEU . 3.3 m-30 -63.69 -33.65 76.11 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.189 0.519 . . . . 0.0 109.64 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.548 ' HA ' HD11 ' A' ' 88' ' ' LEU . 65.2 t80 -65.62 -51.91 56.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.204 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.454 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 27.4 mmmt -79.69 -15.5 57.42 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.547 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.4 tpt -45.2 -44.29 10.84 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.597 0.759 . . . . 0.0 112.519 -170.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.551 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -137.41 10.29 2.96 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.689 -0.404 . . . . 0.0 110.706 -177.569 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.714 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 27.1 t70 -83.2 88.69 6.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.243 0.544 . . . . 0.0 110.21 -179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.453 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 26.7 m-85 -110.46 -0.91 17.28 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.683 -0.689 . . . . 0.0 110.149 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -87.64 -14.68 39.34 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.582 -174.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.39 17.97 78.0 Favored Glycine 0 CA--C 1.522 0.517 0 C-N-CA 121.162 -0.542 . . . . 0.0 113.425 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -95.41 -5.4 43.27 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 117.706 0.753 . . . . 0.0 111.311 -177.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 64.84 18.25 11.38 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.177 0.591 . . . . 0.0 112.033 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.591 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.5 mm? -130.4 167.76 18.06 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 172.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.548 HD11 ' HA ' ' A' ' 77' ' ' PHE . 68.1 mt -131.04 117.28 18.93 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.813 -179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -93.76 -178.93 4.84 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.143 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -56.68 -33.89 63.64 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.128 -0.558 . . . . 0.0 113.331 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 19.9 mt -69.55 -48.38 60.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.176 0.512 . . . . 0.0 109.932 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.714 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 45.6 mt-10 -62.99 -49.24 75.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.886 0.85 . . . . 0.0 109.39 174.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.805 ' HB3' HG12 ' A' ' 97' ' ' ILE . 19.2 mt -66.57 -9.84 39.31 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.924 -1.034 . . . . 0.0 113.407 -172.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 1.03 ' HA ' HD13 ' A' ' 121' ' ' ILE . 34.6 t -54.57 -31.64 57.03 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.126 -0.23 . . . . 0.0 111.024 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.05 -36.75 13.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.146 0.498 . . . . 0.0 111.339 177.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -82.49 -39.26 22.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.845 -168.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.805 HG12 ' HB3' ' A' ' 93' ' ' LEU . 39.1 mm -67.87 -16.33 20.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 120.959 0.409 . . . . 0.0 111.16 -176.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.568 HG23 HD21 ' A' ' 117' ' ' LEU . 8.7 m -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.471 175.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.413 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 64.3 m-70 -102.86 -23.72 13.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.275 174.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.761 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 73.4 t -77.97 -63.8 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.729 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.486 ' CD2' HG13 ' A' ' 120' ' ' ILE . 13.3 t60 -82.84 86.04 6.99 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.249 0.547 . . . . 0.0 110.324 -176.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.526 ' HE2' ' O ' ' A' ' 144' ' ' SER . 0.0 OUTLIER -111.67 176.71 4.91 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.708 -177.724 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -124.15 -39.82 2.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.684 175.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -122.28 -42.28 2.37 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -80.84 178.82 53.86 Favored Glycine 0 C--O 1.226 -0.371 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.438 -177.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.9 m -131.28 -84.14 0.51 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 110.02 -0.363 . . . . 0.0 110.02 173.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -76.93 -2.41 33.52 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-O 121.537 0.684 . . . . 0.0 110.3 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -101.95 116.52 32.88 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.909 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.53 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -71.85 118.88 70.68 Favored Pre-proline 0 CA--C 1.507 -0.688 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.302 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -89.41 67.72 2.31 Favored 'Trans proline' 0 N--CA 1.432 -2.132 0 C-N-CA 122.015 1.81 . . . . 0.0 111.177 175.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 52.7 tp -59.0 84.25 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 121.792 0.806 . . . . 0.0 110.781 174.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.438 ' H ' ' HG2' ' A' ' 112' ' ' MET . 15.5 ptt? -81.96 -55.95 4.27 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.86 -178.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.9 m -162.09 118.72 2.06 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.564 ' O ' HG13 ' A' ' 118' ' ' ILE . 2.5 pm0 -57.47 -34.82 69.41 Favored 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -173.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.404 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 16.7 t70 -69.9 -42.6 73.16 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.285 0.564 . . . . 0.0 109.946 -178.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -68.32 -37.26 80.41 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.292 175.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.568 HD21 HG23 ' A' ' 98' ' ' THR . 11.7 tp -61.89 -36.45 81.32 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.956 177.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 114' ' ' GLU . 61.8 mt -57.7 -47.4 85.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.436 174.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -67.14 -27.01 66.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 176.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.496 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -69.66 -38.49 76.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.695 175.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 1.03 HD13 ' HA ' ' A' ' 94' ' ' SER . 76.1 mt -74.78 -18.29 16.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-O 121.536 0.684 . . . . 0.0 109.806 176.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.665 ' O ' ' HG2' ' A' ' 126' ' ' ARG . 4.5 m-20 -75.35 -42.41 54.27 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 166.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.4 -38.26 68.83 Favored Glycine 0 C--O 1.227 -0.29 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.037 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.769 HG23 ' HB2' ' A' ' 128' ' ' ASP . 7.5 p -59.34 -49.19 84.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 117.468 0.634 . . . . 0.0 109.765 176.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.5 mt -69.89 -8.39 48.25 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.221 0.534 . . . . 0.0 111.269 -178.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.665 ' HG2' ' O ' ' A' ' 122' ' ' ASP . 39.7 mmt-85 -100.56 -31.91 11.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.499 -179.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.36 -48.9 0.78 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.769 ' HB2' HG23 ' A' ' 124' ' ' VAL . 32.8 m-20 -65.96 -25.99 67.36 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 121.492 0.663 . . . . 0.0 110.137 -177.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.831 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -72.42 90.8 1.32 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.924 -1.034 . . . . 0.0 108.735 168.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.84 -29.8 50.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.523 -169.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -90.86 -6.05 54.74 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.333 0.587 . . . . 0.0 111.024 -177.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.831 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 9.5 m120 55.95 49.46 15.8 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.353 -177.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.4 p30 -95.22 -8.1 37.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.146 -0.934 . . . . 0.0 109.199 175.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 87.66 -1.3 85.49 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.45 177.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.591 ' HB2' HD12 ' A' ' 87' ' ' LEU . 24.1 m-85 -131.42 176.03 8.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 109.983 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.529 HD12 ' CG2' ' A' ' 124' ' ' VAL . 10.1 tt -112.09 118.7 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.796 0.808 . . . . 0.0 110.507 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -93.58 170.65 9.43 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.583 177.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.864 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.2 t80 -46.62 -54.94 8.46 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.061 0.544 . . . . 0.0 111.224 -178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.19 -25.88 68.54 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.021 0.439 . . . . 0.0 111.839 -176.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.535 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -77.81 -52.76 8.39 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.937 -175.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.864 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -72.64 -31.07 64.83 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.644 178.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -57.76 -40.54 79.98 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 120.889 0.376 . . . . 0.0 110.791 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -76.94 -29.25 55.55 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.283 -0.567 . . . . 0.0 111.333 177.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.526 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 22.7 t -82.8 -38.15 23.51 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.025 -170.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.838 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp -77.55 -26.19 50.76 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.662 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.445 HE21 HD12 ' A' ' 145' ' ' LEU . 18.6 mm-40 . . . . . 0 C--O 1.242 0.667 0 CA-C-O 118.845 -0.597 . . . . 0.0 111.44 -176.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.644 ' HB2' HD21 ' A' ' 72' ' ' LEU . 88.6 mmm . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.9 p -116.22 159.65 38.85 Favored Pre-proline 0 CA--C 1.539 0.538 0 C-N-CA 121.348 -0.141 . . . . 0.0 111.168 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.509 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 82.6 Cg_exo -49.33 -39.79 43.66 Favored 'Trans proline' 0 N--CA 1.481 0.741 0 C-N-CA 123.608 2.872 . . . . 0.0 115.511 -169.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.474 ' HA ' HE21 ' A' ' 73' ' ' GLN . 0.0 OUTLIER -57.56 -54.79 42.89 Favored 'General case' 0 C--O 1.243 0.729 0 CA-C-O 121.227 0.537 . . . . 0.0 110.648 -175.543 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -76.99 -27.17 54.62 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.886 177.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.644 HD21 ' HB2' ' A' ' 67' ' ' MET . 14.0 mt -65.57 -17.56 64.66 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-O 120.875 0.369 . . . . 0.0 111.502 -179.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.54 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 44.4 mt-30 -71.23 -47.93 54.28 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 171.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.9 tp -60.5 -22.49 63.61 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.016 172.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.555 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 68.7 t60 -67.15 -37.07 83.15 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.329 176.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.539 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 3.8 m-30 -70.34 -34.62 72.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.483 0.659 . . . . 0.0 109.394 177.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.692 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 55.5 t80 -67.78 -52.3 38.81 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.75 -1.114 . . . . 0.0 109.913 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.692 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.2 mmmt -79.34 -14.81 58.74 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.381 -175.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.483 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.0 OUTLIER -45.33 -38.11 5.46 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 124.052 0.845 . . . . 0.0 111.816 -174.401 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.459 ' HB3' ' HA ' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -142.81 9.52 1.75 Allowed 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.713 178.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.502 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 34.7 t70 -85.21 79.51 9.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.863 0.84 . . . . 0.0 109.829 178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 -11.22 24.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.7 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -90.14 -14.71 33.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.526 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.88 24.57 66.82 Favored Glycine 0 CA--C 1.521 0.42 0 CA-C-N 115.328 -0.851 . . . . 0.0 114.92 171.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -87.67 5.23 40.7 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 118.545 1.172 . . . . 0.0 111.012 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.542 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 11.3 m120 70.3 5.74 5.47 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.678 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.556 HD12 ' HB2' ' A' ' 135' ' ' TYR . 3.7 mm? -121.22 145.56 47.72 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.296 0.57 . . . . 0.0 109.932 175.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.487 ' HB3' ' HG ' ' A' ' 93' ' ' LEU . 3.6 mm? -107.44 110.71 22.73 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.149 174.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.588 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 1.4 p30 -84.64 -174.1 5.09 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.189 178.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.08 -47.43 66.94 Favored Glycine 0 N--CA 1.453 -0.226 0 N-CA-C 114.093 0.397 . . . . 0.0 114.093 -176.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.658 HD12 ' N ' ' A' ' 92' ' ' GLU . 3.8 pp -77.14 -28.16 54.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.599 0.699 . . . . 0.0 110.641 -175.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.658 ' N ' HD12 ' A' ' 91' ' ' LEU . 45.5 mt-10 -65.98 -55.08 18.57 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 172.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.939 ' HB3' HG12 ' A' ' 97' ' ' ILE . 32.7 mt -64.21 -12.58 42.03 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.53 -1.214 . . . . 0.0 112.198 -178.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.719 ' HA ' HD13 ' A' ' 121' ' ' ILE . 39.4 m -55.12 -34.13 63.45 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.595 0.236 . . . . 0.0 111.617 178.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -92.81 -31.49 15.0 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.19 0.519 . . . . 0.0 111.225 174.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.456 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . . . -80.04 -42.31 24.01 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.222 -170.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.939 HG12 ' HB3' ' A' ' 93' ' ' LEU . 41.2 mm -62.7 -25.2 37.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 111.055 -176.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.624 HG22 ' HB1' ' A' ' 109' ' ' ALA . 2.7 m -58.69 -18.61 32.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.58 176.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.539 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 72.9 m-70 -115.51 -33.47 5.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.369 172.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.873 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 39.1 t -58.91 -55.46 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 40.2 t60 -74.32 80.4 1.85 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.436 0.636 . . . . 0.0 110.348 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.447 ' HE3' ' O ' ' A' ' 106' ' ' SER . 79.0 tttt -57.66 134.85 56.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.55 -1.205 . . . . 0.0 111.271 -178.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -154.31 -66.56 0.14 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.521 -178.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -80.3 -64.97 1.07 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.656 -0.702 . . . . 0.0 112.063 -174.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.47 ' HA3' ' HG2' ' A' ' 108' ' ' GLN . . . -104.85 -166.41 24.23 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.894 -175.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.447 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 37.6 t -73.67 -75.07 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -118.83 -6.33 10.57 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-O 121.42 0.628 . . . . 0.0 110.087 177.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.47 ' HG2' ' HA3' ' A' ' 105' ' ' GLY . 6.3 pt20 -61.6 156.69 19.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.384 -0.826 . . . . 0.0 110.589 178.258 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.624 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -85.14 114.34 55.49 Favored Pre-proline 0 CA--C 1.507 -0.698 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.491 178.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.442 ' HD3' ' O ' ' A' ' 108' ' ' GLN . 4.4 Cg_exo -74.48 61.38 5.2 Favored 'Trans proline' 0 N--CA 1.448 -1.203 0 C-N-CA 121.904 1.736 . . . . 0.0 110.848 172.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 44.8 tp -71.67 74.54 0.82 Allowed 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 122.185 0.993 . . . . 0.0 110.578 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.472 ' H ' ' HG2' ' A' ' 112' ' ' MET . 10.0 ptt? -75.61 -53.61 8.31 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 113.805 -1.543 . . . . 0.0 110.268 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 49.0 m -159.86 122.9 3.52 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 175.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.57 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -61.09 -33.97 74.2 Favored 'General case' 0 C--O 1.22 -0.455 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -170.179 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.61 -40.71 76.46 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.215 0.531 . . . . 0.0 110.37 179.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 53.0 tt0 -68.85 -36.69 78.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.848 0.832 . . . . 0.0 109.56 174.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.49 ' O ' HG13 ' A' ' 121' ' ' ILE . 1.4 tm? -63.94 -36.81 85.17 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.612 177.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.57 HG13 ' O ' ' A' ' 114' ' ' GLU . 70.1 mt -62.52 -38.95 82.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.669 174.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -64.5 -40.45 95.67 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 174.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.64 -39.35 79.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.595 175.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.878 ' HA ' HG21 ' A' ' 97' ' ' ILE . 76.0 mt -59.85 -47.91 89.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.284 175.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.782 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 34.7 t70 -61.49 -39.89 92.58 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.66 -31.21 52.97 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.873 175.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.847 HG21 HD12 ' A' ' 97' ' ' ILE . 42.9 t -68.25 -49.22 68.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 110.291 -0.262 . . . . 0.0 110.291 174.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 134' ' ' GLY . 8.8 mp -63.63 -10.34 18.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.018 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.782 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 24.2 mtm-85 -102.31 -49.24 3.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.158 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -113.45 -45.1 3.15 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -172.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.609 ' HB2' HG13 ' A' ' 124' ' ' VAL . 10.1 m-20 -68.91 -24.09 64.26 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.898 0.38 . . . . 0.0 110.682 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.564 ' HA ' ' OE1' ' A' ' 140' ' ' GLU . 2.9 t70 -74.68 93.52 2.57 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.88 0.847 . . . . 0.0 108.962 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 10.4 mmmm -79.08 -18.88 52.59 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.167 -172.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -96.93 -2.35 43.9 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.202 -171.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.3 t30 60.64 32.91 20.4 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.389 -177.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.6 p30 -99.0 -1.98 38.45 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 121.061 0.458 . . . . 0.0 110.067 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.451 ' O ' ' HG ' ' A' ' 125' ' ' LEU . . . 82.02 -24.42 4.65 Favored Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.735 -0.666 . . . . 0.0 113.35 173.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.556 ' HB2' HD12 ' A' ' 87' ' ' LEU . 18.5 m-85 -116.48 -179.19 3.6 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.932 0.396 . . . . 0.0 110.59 -176.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.714 HG12 ' HG3' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -110.82 129.73 65.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.388 0.613 . . . . 0.0 112.091 179.206 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.474 ' H ' ' HG2' ' A' ' 140' ' ' GLU . 12.2 t70 -103.11 168.09 9.41 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.473 172.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.876 ' HA ' ' CE2' ' A' ' 141' ' ' PHE . 21.5 t80 -50.86 -44.05 59.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.718 0.294 . . . . 0.0 110.834 -177.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.443 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -67.81 -31.31 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -173.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.714 ' HG3' HG12 ' A' ' 136' ' ' ILE . 12.7 pt-20 -91.19 -30.06 16.88 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.508 -169.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.876 ' CE2' ' HA ' ' A' ' 138' ' ' TYR . 2.1 p90 -76.11 -32.06 58.99 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.21 171.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.53 ' O ' ' HG2' ' A' ' 146' ' ' GLN . . . -64.13 -43.02 96.57 Favored 'General case' 0 CA--C 1.511 -0.548 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.407 -178.098 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.0 mtmt -72.77 -28.78 62.81 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.351 176.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 32.3 t -70.04 -35.15 74.06 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.943 0.401 . . . . 0.0 110.274 -177.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.592 HD12 HE21 ' A' ' 146' ' ' GLN . 4.3 pp -86.22 10.77 13.66 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.475 -177.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.592 HE21 HD12 ' A' ' 145' ' ' LEU . 27.7 mm-40 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.335 -0.841 . . . . 0.0 110.425 177.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.823 ' HB2' HD21 ' A' ' 72' ' ' LEU . 98.2 mmm . . . . . 0 N--CA 1.468 0.462 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.718 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 26.6 m -98.4 139.4 21.15 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-O 120.997 0.427 . . . . 0.0 110.625 178.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.768 ' HA ' ' HB2' ' A' ' 72' ' ' LEU . 73.3 Cg_exo -50.92 -27.97 22.49 Favored 'Trans proline' 0 N--CA 1.477 0.51 0 C-N-CA 124.085 3.19 . . . . 0.0 115.15 -172.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -65.06 -51.32 62.18 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-O 120.731 0.301 . . . . 0.0 111.017 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.718 ' HG2' ' O ' ' A' ' 68' ' ' SER . 3.0 pm0 -72.33 -26.36 61.9 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.09 173.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.823 HD21 ' HB2' ' A' ' 67' ' ' MET . 39.5 mt -66.82 -17.5 64.91 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.688 0.28 . . . . 0.0 111.627 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 42.4 mt-30 -73.08 -40.97 64.58 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 171.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 53.2 tp -66.88 -21.88 65.99 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 171.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.582 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 5.0 t60 -66.91 -35.0 79.01 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.103 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.591 ' OH ' ' HA ' ' A' ' 107' ' ' GLU . 4.0 m-30 -72.1 -33.58 67.97 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 176.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.552 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 54.3 t80 -67.09 -53.08 34.26 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.154 178.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.552 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 26.9 mmmt -80.53 -11.12 59.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.596 -176.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.427 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 3.5 tpt -43.12 -43.41 4.47 Favored 'General case' 0 N--CA 1.472 0.632 0 O-C-N 124.069 0.856 . . . . 0.0 112.005 -172.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.539 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -141.06 10.06 2.14 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.88 179.332 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.745 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 34.2 t70 -82.07 80.7 8.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.31 0.576 . . . . 0.0 110.854 -176.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.539 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 3.9 m-85 -108.32 -6.11 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.738 178.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 31.5 p30 -75.8 -13.68 60.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.734 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.67 23.66 72.13 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 116.025 -0.534 . . . . 0.0 113.464 175.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -108.41 -8.65 15.55 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 117.616 0.708 . . . . 0.0 110.964 178.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.444 ' HB3' ' HZ ' ' A' ' 77' ' ' PHE . 13.1 m120 64.41 20.58 12.21 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 115.811 -0.632 . . . . 0.0 111.564 177.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.49 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.9 mm? -127.89 157.04 41.6 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.609 ' HB2' HG22 ' A' ' 136' ' ' ILE . 83.2 mt -113.2 110.82 21.03 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.045 0.45 . . . . 0.0 111.537 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.524 ' HA ' ' CD2' ' A' ' 135' ' ' TYR . 8.0 t70 -83.31 161.45 21.42 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.818 -1.083 . . . . 0.0 110.565 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -44.59 -56.14 5.77 Favored Glycine 0 N--CA 1.464 0.514 0 N-CA-C 114.909 0.723 . . . . 0.0 114.909 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.687 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -73.55 -30.99 63.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.644 0.722 . . . . 0.0 111.262 -174.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.745 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 38.7 tt0 -69.61 -58.62 3.72 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 122.292 1.044 . . . . 0.0 108.768 176.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.951 ' HG ' HG12 ' A' ' 97' ' ' ILE . 40.7 tp -61.92 -10.44 9.5 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 113.424 -1.716 . . . . 0.0 111.755 -179.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.849 ' HA ' HD13 ' A' ' 121' ' ' ILE . 18.8 m -51.94 -32.37 32.76 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.143 179.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.1 m -85.76 -27.34 25.28 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.531 -179.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.826 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -85.17 -37.89 19.64 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -172.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.951 HG12 ' HG ' ' A' ' 93' ' ' LEU . 46.1 mm -64.3 -21.76 29.71 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 CA-C-O 120.902 0.382 . . . . 0.0 111.037 -177.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.647 HG22 ' HB1' ' A' ' 109' ' ' ALA . 4.2 m -57.58 -31.09 65.81 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.972 174.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.552 ' ND1' ' HB2' ' A' ' 109' ' ' ALA . 98.7 m-70 -101.42 -32.97 10.18 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.555 176.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.828 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 36.7 t -56.89 -52.42 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.486 0.184 . . . . 0.0 110.875 177.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -69.23 81.18 0.35 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 120.522 -0.471 . . . . 0.0 110.216 171.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.496 ' HG2' ' O ' ' A' ' 145' ' ' LEU . 1.3 pptp? -64.54 153.64 38.5 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.862 176.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -144.88 -67.85 0.31 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.845 0.355 . . . . 0.0 110.67 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -90.69 -10.18 44.06 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.405 0.621 . . . . 0.0 110.372 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.467 ' HA3' ' OE1' ' A' ' 108' ' ' GLN . . . -175.45 174.12 46.64 Favored Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 178.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 19.8 m -67.65 -66.66 0.53 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.557 0.679 . . . . 0.0 110.771 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.591 ' HA ' ' OH ' ' A' ' 76' ' ' TYR . 31.4 mm-40 -73.26 -17.64 61.31 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 121.368 0.604 . . . . 0.0 110.938 -179.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.467 ' OE1' ' HA3' ' A' ' 105' ' ' GLY . 51.9 mt-30 -71.52 107.57 4.48 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.483 -176.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.647 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -76.83 122.92 87.3 Favored Pre-proline 0 CA--C 1.502 -0.878 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.339 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -83.04 67.1 7.79 Favored 'Trans proline' 0 N--CA 1.436 -1.862 0 C-N-CA 121.555 1.503 . . . . 0.0 111.305 175.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.4 tp -65.22 79.61 0.05 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 122.368 1.08 . . . . 0.0 109.852 173.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.447 ' H ' ' HG2' ' A' ' 112' ' ' MET . 9.0 ptt? -92.15 -58.35 2.42 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 113.631 -1.622 . . . . 0.0 110.436 -176.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.6 m -161.02 120.95 2.68 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.49 ' O ' HG13 ' A' ' 118' ' ' ILE . 9.2 pt-20 -56.39 -27.03 55.11 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -174.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -64.84 -47.18 78.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.375 0.607 . . . . 0.0 110.12 176.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.19 -38.8 85.97 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 177.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.437 HD22 ' HA ' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -60.65 -38.69 85.69 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.355 178.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 114' ' ' GLU . 30.9 mt -59.39 -50.62 79.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.517 174.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -64.2 -33.01 74.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.132 0.491 . . . . 0.0 110.357 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.2 mp -63.73 -45.68 96.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.483 -0.781 . . . . 0.0 111.01 176.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.857 ' HA ' HG21 ' A' ' 97' ' ' ILE . 71.7 mt -62.94 -44.94 99.94 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 CA-C-O 121.141 0.496 . . . . 0.0 109.705 176.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.758 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.7 t70 -57.55 -44.55 85.29 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.429 -179.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -56.46 -31.77 60.28 Favored Glycine 0 C--N 1.334 0.453 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.448 177.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.916 HG21 HD12 ' A' ' 97' ' ' ILE . 44.5 t -63.39 -51.62 68.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.877 0.37 . . . . 0.0 110.271 173.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.9 mp -67.62 -6.82 22.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.275 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.758 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 19.7 mtm180 -101.64 -47.77 4.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.045 178.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -115.56 -44.88 2.93 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -171.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.504 ' HB2' HG13 ' A' ' 124' ' ' VAL . 17.4 m-20 -70.96 -22.06 62.25 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.025 0.44 . . . . 0.0 111.049 -177.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -80.12 84.34 5.84 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 168.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -71.55 -26.65 62.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.944 -1.025 . . . . 0.0 109.756 -174.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . 0.476 ' HB2' ' OD1' ' A' ' 133' ' ' ASP . 3.6 m120 -76.45 -14.72 60.04 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.305 -173.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 8.7 t30 63.41 25.94 14.75 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 121.663 0.744 . . . . 0.0 109.221 -175.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 131' ' ' ASN . 3.0 p30 -92.47 -15.0 27.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.837 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 101.5 -25.34 28.43 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.9 176.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.524 ' CD2' ' HA ' ' A' ' 89' ' ' ASP . 14.2 m-85 -116.42 162.79 17.02 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.176 -176.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.609 HG22 ' HB2' ' A' ' 88' ' ' LEU . 7.3 tt -96.65 130.89 44.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.465 0.65 . . . . 0.0 110.263 178.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -103.02 172.03 7.05 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.53 179.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.812 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 11.2 t80 -53.25 -48.03 68.57 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 123.135 0.272 . . . . 0.0 110.752 -177.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 143' ' ' LYS . . . -64.44 -31.21 72.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.485 -176.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -75.87 -52.43 10.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.573 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.812 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.0 p90 -70.16 -28.05 65.02 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.397 179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.57 -40.37 96.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-O 120.941 0.401 . . . . 0.0 110.447 177.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 139' ' ' ALA . 49.8 mtmt -74.14 -28.81 61.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.762 176.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 13.7 t -80.94 -33.86 33.72 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.97 -174.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.496 ' O ' ' HG2' ' A' ' 102' ' ' LYS . 4.0 pp -83.39 -42.05 17.46 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.336 -0.228 . . . . 0.0 111.502 -178.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.809 179.277 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.504 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 91.7 mmm . . . . . 0 N--CA 1.464 0.256 0 N-CA-C 110.043 -0.355 . . . . 0.0 110.043 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.495 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 0.7 OUTLIER -93.9 161.34 30.28 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.543 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 10.1 Cg_endo -52.29 -46.62 31.64 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.145 2.563 . . . . 0.0 113.82 -172.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -61.63 -50.28 73.17 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.252 -172.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.437 ' OE1' ' HB2' ' A' ' 68' ' ' SER . 7.8 pm0 -71.97 -28.94 63.76 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.398 176.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.507 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 13.0 mt -66.76 -21.13 66.07 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.3 179.309 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.55 ' HG2' HD12 ' A' ' 145' ' ' LEU . 24.8 mt-30 -69.35 -46.46 66.95 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 173.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.7 tp -64.47 -21.93 66.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.757 172.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.507 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 25.5 t60 -69.99 -44.29 69.69 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.175 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.597 ' HE2' ' CD2' ' A' ' 145' ' ' LEU . 5.3 m-30 -67.58 -26.82 66.47 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.527 0.68 . . . . 0.0 109.371 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.641 ' HA ' HD11 ' A' ' 88' ' ' LEU . 48.6 t80 -74.87 -52.61 10.87 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 114.526 -1.215 . . . . 0.0 109.989 179.182 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.549 ' HA ' ' HE3' ' A' ' 78' ' ' LYS . 19.7 mmmt -81.15 -24.63 37.44 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -174.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 18.2 tpp -44.84 -46.06 10.53 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -172.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.723 ' CD2' ' HB3' ' A' ' 92' ' ' GLU . 1.8 p-80 -130.26 8.28 5.08 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.578 -169.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.645 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 29.3 t70 -84.49 64.84 8.64 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.961 0.886 . . . . 0.0 109.357 -177.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -95.66 3.29 54.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.627 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.0 p30 -89.27 -14.24 36.28 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.771 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.14 26.63 71.84 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.557 -0.747 . . . . 0.0 113.85 175.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.5 p30 -109.03 -1.74 18.68 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 117.714 0.757 . . . . 0.0 112.259 -179.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 67.99 14.31 9.32 Favored 'General case' 0 N--CA 1.471 0.579 0 O-C-N 123.365 0.416 . . . . 0.0 111.512 176.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.536 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.8 mm? -126.35 155.25 42.36 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 175.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.701 HD22 ' CD2' ' A' ' 80' ' ' HIS . 17.8 mt -111.69 113.63 26.12 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.201 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -90.27 176.12 6.86 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.546 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -54.03 -51.88 47.03 Favored Glycine 0 CA--C 1.518 0.223 0 N-CA-C 114.238 0.455 . . . . 0.0 114.238 -178.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.611 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.0 pp -73.81 -26.28 60.53 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.359 0.579 . . . . 0.0 110.77 -173.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.723 ' HB3' ' CD2' ' A' ' 80' ' ' HIS . 46.9 mt-10 -65.0 -54.8 24.69 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-O 122.112 0.958 . . . . 0.0 108.509 168.163 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.88 ' HB3' HG12 ' A' ' 97' ' ' ILE . 57.1 mt -60.46 -10.04 4.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.077 -1.419 . . . . 0.0 112.53 -175.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.68 ' HA ' HD13 ' A' ' 121' ' ' ILE . 85.0 p -51.49 -33.08 29.93 Favored 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.54 0.525 . . . . 0.0 111.55 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -90.26 -33.33 16.18 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.66 ' HB3' ' HE1' ' A' ' 80' ' ' HIS . . . -93.96 -32.21 13.95 Favored 'General case' 0 CA--C 1.519 -0.24 0 N-CA-C 112.454 0.538 . . . . 0.0 112.454 -168.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.881 HD12 HG21 ' A' ' 124' ' ' VAL . 35.3 mm -65.4 -23.18 32.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.267 0.556 . . . . 0.0 110.445 -177.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.769 HG23 HD21 ' A' ' 117' ' ' LEU . 13.4 m -60.07 -17.84 42.42 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.9 174.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -110.59 -38.3 5.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.032 173.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.767 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 54.9 t -56.85 -59.53 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.116 179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.431 ' CD2' HG13 ' A' ' 120' ' ' ILE . 7.7 t60 -85.47 65.35 9.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.401 0.62 . . . . 0.0 109.423 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 105' ' ' GLY . 20.2 pttp -59.47 161.61 5.65 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.543 -1.208 . . . . 0.0 112.397 -177.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -140.7 -80.53 0.26 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.957 -179.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -75.89 -60.48 2.3 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.869 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 102' ' ' LYS . . . -83.99 165.44 41.68 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 174.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.452 ' HA ' ' HD2' ' A' ' 102' ' ' LYS . 19.9 m -95.02 -61.23 1.52 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.937 0.399 . . . . 0.0 110.739 -177.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -108.5 3.86 23.57 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.742 0.782 . . . . 0.0 110.228 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.469 ' CG ' ' HA3' ' A' ' 105' ' ' GLY . 4.4 pt20 -105.54 147.3 28.52 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.712 177.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.44 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -77.07 116.96 61.81 Favored Pre-proline 0 CA--C 1.508 -0.639 0 CA-C-O 120.506 0.193 . . . . 0.0 111.002 -176.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 109' ' ' ALA . 11.8 Cg_endo -91.38 69.37 1.1 Allowed 'Trans proline' 0 N--CA 1.435 -1.921 0 C-N-CA 122.231 1.954 . . . . 0.0 111.678 175.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 97.8 mt -51.1 93.4 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.669 0.747 . . . . 0.0 110.967 173.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 19.5 ptt? -100.82 -55.29 2.61 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.623 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.7 m -160.74 118.28 2.43 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.489 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.7 OUTLIER -55.41 -36.64 66.67 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -174.541 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -67.57 -49.67 62.1 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.108 0.48 . . . . 0.0 110.154 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -58.28 -36.93 74.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.202 174.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.769 HD21 HG23 ' A' ' 98' ' ' THR . 9.8 tp -66.44 -41.09 89.68 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.323 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.2 mt -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.392 175.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -70.77 -31.47 68.28 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.431 177.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.431 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.0 OUTLIER -62.02 -38.54 81.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.273 175.911 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.874 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -64.08 -41.6 92.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.914 176.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.705 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 36.1 t70 -62.3 -44.1 97.3 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.613 179.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -55.91 -30.24 56.65 Favored Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.492 177.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.881 HG21 HD12 ' A' ' 97' ' ' ILE . 42.7 t -63.67 -50.49 77.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.996 0.427 . . . . 0.0 110.362 174.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.27 -6.25 22.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.051 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.705 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 27.8 mtm-85 -98.88 -48.47 4.9 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.055 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -121.27 -39.65 2.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -173.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.537 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 21.6 m-20 -67.48 -21.89 65.49 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.031 0.443 . . . . 0.0 110.967 -178.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.525 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.7 t70 -76.1 92.64 3.23 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 166.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.8 mmmt -78.96 -27.69 43.58 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.471 -168.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -103.51 4.84 36.34 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.974 -170.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.525 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 65.0 t30 57.35 53.29 7.73 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.133 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.8 p30 -108.49 -3.86 17.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.773 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 88.15 -18.9 37.92 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.94 175.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.536 ' HB2' HD12 ' A' ' 87' ' ' LEU . 48.8 m-85 -117.36 177.34 4.77 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.878 0.37 . . . . 0.0 110.025 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.573 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.3 tt -113.38 123.52 69.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-O 121.403 0.62 . . . . 0.0 109.492 174.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -101.62 -179.34 3.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.836 177.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.872 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 9.4 t80 -52.2 -51.19 59.65 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.579 0.549 . . . . 0.0 111.476 -173.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.54 -22.04 64.52 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.772 0.286 . . . . 0.0 111.772 -175.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.468 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 52.6 mt-10 -80.08 -50.8 9.83 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 -174.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.872 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 5.0 p90 -71.44 -33.59 69.51 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 119.707 -0.797 . . . . 0.0 109.84 177.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.56 -38.12 77.16 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 120.848 0.356 . . . . 0.0 110.821 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -73.08 -29.22 62.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.111 176.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.471 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 7.7 t -81.14 -18.9 44.77 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 -174.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.758 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 91.3 mt -85.51 1.43 48.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 114.376 -1.284 . . . . 0.0 110.989 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 . . . . . 0 C--O 1.243 0.759 0 CA-C-O 118.668 -0.682 . . . . 0.0 110.303 179.327 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.701 ' HB2' ' CD1' ' A' ' 72' ' ' LEU . 85.6 mmm . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.8 m -96.69 153.45 38.73 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 119.42 -0.324 . . . . 0.0 110.166 177.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -49.36 -43.1 39.28 Favored 'Trans proline' 0 N--CA 1.479 0.657 0 C-N-CA 122.931 2.421 . . . . 0.0 113.573 -173.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -56.72 -44.87 82.04 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.055 177.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.422 ' H ' ' HG2' ' A' ' 71' ' ' GLU . 2.0 mm-40 -64.93 -43.8 91.58 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.279 174.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.701 ' CD1' ' HB2' ' A' ' 67' ' ' MET . 7.7 mp -57.2 -24.8 56.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 112.57 0.582 . . . . 0.0 112.57 -169.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.61 ' HG2' HD21 ' A' ' 145' ' ' LEU . 10.2 mt-30 -63.9 -50.42 68.81 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 173.473 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 34.2 tp -63.49 -24.07 67.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.011 172.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.579 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 13.7 t60 -66.62 -38.25 86.54 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 177.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.52 ' CZ ' ' HB3' ' A' ' 99' ' ' HIS . 4.3 m-30 -71.92 -37.02 70.13 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.66 ' HA ' HD11 ' A' ' 88' ' ' LEU . 48.7 t80 -62.16 -52.75 62.56 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.943 178.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 24.2 mmmt -80.24 -13.66 59.05 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.57 -177.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.63 -45.83 9.8 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 124.044 0.84 . . . . 0.0 111.069 -171.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.485 ' CD2' ' HE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -139.54 9.97 2.46 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.966 -178.634 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.75 ' HA ' ' OE1' ' A' ' 92' ' ' GLU . 26.2 t70 -85.07 82.96 8.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.892 0.853 . . . . 0.0 109.758 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.485 ' HE1' ' CD2' ' A' ' 80' ' ' HIS . 0.7 OUTLIER -121.63 15.17 11.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.173 -1.376 . . . . 0.0 110.144 -177.254 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -95.12 -13.33 25.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.219 -175.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 12.14 80.59 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.249 176.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -98.34 -4.15 35.55 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 117.394 0.597 . . . . 0.0 111.065 -178.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 58.38 34.4 23.97 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.605 176.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.451 HD22 ' HB2' ' A' ' 135' ' ' TYR . 7.9 mt -151.54 149.37 29.12 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.563 177.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.66 HD11 ' HA ' ' A' ' 77' ' ' PHE . 68.8 mt -94.81 113.21 24.94 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.973 0.416 . . . . 0.0 111.823 -177.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.485 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 8.9 t70 -91.71 167.0 12.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 114.563 -1.199 . . . . 0.0 110.391 177.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -50.86 -49.93 39.82 Favored Glycine 0 C--N 1.33 0.247 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 -175.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.66 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.2 pp -68.92 -29.22 67.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 117.413 0.606 . . . . 0.0 110.631 -176.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.75 ' OE1' ' HA ' ' A' ' 81' ' ' ASP . 50.8 mt-10 -69.83 -48.54 58.58 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 173.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.826 ' HB3' HG12 ' A' ' 97' ' ' ILE . 25.2 mt -65.26 -11.24 39.3 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.31 -178.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.672 ' HA ' HD13 ' A' ' 121' ' ' ILE . 65.9 m -58.46 -33.35 69.65 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 116.689 -0.232 . . . . 0.0 110.832 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -93.35 -27.67 16.63 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 121.217 0.532 . . . . 0.0 111.482 174.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.438 ' HB3' ' HA ' ' A' ' 93' ' ' LEU . . . -86.51 -41.43 14.36 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -169.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.899 HG21 ' HA ' ' A' ' 121' ' ' ILE . 43.0 mm -64.43 -21.13 28.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.012 0.434 . . . . 0.0 110.692 -178.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.717 HG22 ' HB1' ' A' ' 109' ' ' ALA . 2.6 m -58.12 -21.95 48.83 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.54 174.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.52 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 80.6 m-70 -115.16 -6.2 12.44 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.322 176.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.736 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 42.0 t -90.13 -46.39 14.97 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 -179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 61.1 t-80 -66.05 93.99 0.22 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.771 0.32 . . . . 0.0 111.432 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -65.22 137.94 57.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.073 177.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 179.0 -67.98 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.295 174.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.5 ' HB2' ' HB3' ' A' ' 110' ' ' PRO . 13.0 tp10 -64.94 -29.81 70.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 122.013 0.911 . . . . 0.0 108.902 173.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.608 ' HA3' ' HG2' ' A' ' 108' ' ' GLN . . . -171.02 -178.09 41.33 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 114.065 -1.425 . . . . 0.0 109.555 174.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.504 ' HB3' ' O ' ' A' ' 145' ' ' LEU . 53.9 m -98.42 -42.53 7.3 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 117.377 0.589 . . . . 0.0 110.336 178.162 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -97.61 -28.21 14.03 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.568 -179.083 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.608 ' HG2' ' HA3' ' A' ' 105' ' ' GLY . 20.6 pt20 -83.82 149.95 26.07 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.135 0.493 . . . . 0.0 111.406 -174.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.717 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -85.39 122.5 73.59 Favored Pre-proline 0 CA--C 1.512 -0.513 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.893 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.5 ' HB3' ' HB2' ' A' ' 104' ' ' GLU . 3.4 Cg_exo -80.78 72.56 6.46 Favored 'Trans proline' 0 N--CA 1.444 -1.42 0 C-N-CA 122.083 1.855 . . . . 0.0 111.795 173.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.23 80.44 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.921 0.867 . . . . 0.0 110.383 169.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.424 ' H ' ' HG2' ' A' ' 112' ' ' MET . 15.1 ptt? -98.94 -60.51 1.52 Allowed 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.668 -178.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.8 m -165.6 120.19 1.24 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.07 -35.29 66.8 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -172.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.2 -46.79 88.99 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.217 0.532 . . . . 0.0 110.544 179.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.03 -33.65 63.83 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.115 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.67 HD21 HG23 ' A' ' 98' ' ' THR . 17.0 tp -61.25 -39.01 88.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.998 175.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 51.3 mt -61.38 -44.01 97.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.129 175.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -68.27 -33.13 73.79 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.395 0.617 . . . . 0.0 110.331 176.042 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.1 mp -60.48 -40.53 84.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.416 174.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.899 ' HA ' HG21 ' A' ' 97' ' ' ILE . 90.3 mt -61.79 -46.49 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.146 177.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.76 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 38.7 t70 -58.7 -44.43 90.33 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.556 -179.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -53.87 -33.89 50.59 Favored Glycine 0 C--N 1.332 0.321 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.184 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.821 HG21 HD12 ' A' ' 97' ' ' ILE . 39.8 t -63.0 -53.84 41.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 120.582 0.23 . . . . 0.0 110.872 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.536 HD11 HD12 ' A' ' 93' ' ' LEU . 9.0 mp -63.95 -14.52 54.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.967 -178.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.76 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 18.4 mtm180 -95.0 -50.14 5.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.251 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -117.7 -41.3 2.94 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -170.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.511 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -68.1 -18.79 64.75 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.523 0.678 . . . . 0.0 109.669 178.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.642 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 3.2 t70 -72.34 90.68 1.29 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.777 -1.101 . . . . 0.0 108.693 165.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -79.51 -16.85 55.31 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.276 -170.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -113.4 13.36 18.96 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -171.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 64.8 t30 53.8 50.11 17.67 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.19 -0.914 . . . . 0.0 112.27 173.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 15.5 p30 -110.9 -9.02 14.46 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.553 -0.459 . . . . 0.0 109.997 173.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 79.72 0.78 85.68 Favored Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.524 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.451 ' HB2' HD22 ' A' ' 87' ' ' LEU . 87.2 m-85 -126.08 175.35 7.81 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.593 HG22 ' HB2' ' A' ' 88' ' ' LEU . 10.2 tt -118.56 121.11 66.22 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.421 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -99.92 -176.87 3.37 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.308 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.847 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 5.2 t80 -53.41 -50.2 65.69 Favored 'General case' 0 C--O 1.225 -0.227 0 O-C-N 123.66 0.6 . . . . 0.0 111.812 -173.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.79 -35.14 78.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.768 0.318 . . . . 0.0 110.756 -176.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.642 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 48.9 mt-10 -66.21 -53.79 32.94 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.815 -174.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.847 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 2.2 p90 -73.08 -32.03 64.74 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 119.956 -0.698 . . . . 0.0 110.798 179.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.61 97.73 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.124 0.487 . . . . 0.0 110.117 178.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 17.6 mtpp -70.09 -29.03 65.91 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.927 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 9.6 t -82.45 -32.78 28.79 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.608 -175.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.61 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.5 pp -84.04 12.85 5.69 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.205 0.526 . . . . 0.0 111.065 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.423 -0.799 . . . . 0.0 110.535 178.55 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.649 ' HB2' HD21 ' A' ' 72' ' ' LEU . 97.7 mmm . . . . . 0 CA--C 1.518 -0.266 0 CA-C-O 120.869 0.366 . . . . 0.0 110.45 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.48 ' HB2' ' OE2' ' A' ' 71' ' ' GLU . 49.1 m -97.79 161.96 23.95 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.324 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.525 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 72.8 Cg_exo -50.83 -46.48 30.18 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.94 2.426 . . . . 0.0 114.57 -172.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -59.6 -49.23 78.55 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.48 ' OE2' ' HB2' ' A' ' 68' ' ' SER . 1.6 pm0 -78.35 -26.13 46.6 Favored 'General case' 0 C--O 1.223 -0.305 0 O-C-N 122.048 -0.407 . . . . 0.0 111.121 176.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.649 HD21 ' HB2' ' A' ' 67' ' ' MET . 11.8 mt -64.41 -20.02 65.89 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.533 ' HB2' ' OH ' ' A' ' 138' ' ' TYR . 29.6 mt-30 -73.35 -43.04 61.51 Favored 'General case' 0 C--N 1.308 -1.227 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 174.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 51.5 tp -65.61 -23.82 66.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.715 173.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.515 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 46.3 t60 -64.3 -37.29 86.98 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 176.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.461 ' HD1' HG22 ' A' ' 100' ' ' VAL . 4.2 m-30 -69.26 -35.31 75.95 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.629 177.666 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.574 ' HD1' ' HE2' ' A' ' 141' ' ' PHE . 62.9 t80 -68.72 -50.33 51.67 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.514 -178.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 27.3 mmmt -80.05 -13.71 59.1 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.361 -177.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -45.06 -41.29 7.49 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 123.94 0.775 . . . . 0.0 112.937 -172.035 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.586 ' HB3' ' HB3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -141.49 10.52 2.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.904 -178.052 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.677 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 23.5 t70 -82.83 81.93 8.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.823 0.82 . . . . 0.0 109.681 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -113.56 15.62 18.91 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.723 -176.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.0 p30 -99.69 -13.14 19.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.88 -178.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 71.2 29.42 68.63 Favored Glycine 0 N--CA 1.448 -0.558 0 CA-C-N 115.644 -0.707 . . . . 0.0 113.021 179.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -106.83 -3.58 20.21 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.477 0.638 . . . . 0.0 111.342 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.8 t30 60.65 42.42 13.87 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.586 178.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.497 HD22 ' HB2' ' A' ' 135' ' ' TYR . 6.0 mt -158.3 153.56 25.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.419 177.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.582 ' HB2' HG22 ' A' ' 136' ' ' ILE . 96.4 mt -106.15 113.34 26.82 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.912 0.387 . . . . 0.0 111.29 178.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.516 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 16.8 t70 -87.33 157.57 19.25 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.744 172.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -46.93 -35.74 8.2 Favored Glycine 0 CA--C 1.522 0.512 0 C-N-CA 121.204 -0.522 . . . . 0.0 113.671 -177.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.516 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 36.0 mt -65.42 -40.71 93.68 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.975 0.417 . . . . 0.0 111.656 -178.066 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.677 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 27.9 mt-10 -74.6 -44.22 51.79 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.549 1.166 . . . . 0.0 108.82 172.555 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.931 ' HG ' HG12 ' A' ' 97' ' ' ILE . 10.7 tp -63.77 -12.97 39.81 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 113.286 -1.779 . . . . 0.0 111.917 -169.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.885 ' HA ' HD13 ' A' ' 121' ' ' ILE . 40.9 p -51.82 -48.77 63.76 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.419 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -78.29 -26.94 47.23 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.205 0.526 . . . . 0.0 111.397 -176.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.62 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -80.98 -42.5 21.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.657 -173.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.931 HG12 ' HG ' ' A' ' 93' ' ' LEU . 45.1 mm -66.05 -17.41 22.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.043 0.449 . . . . 0.0 111.151 -177.303 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.632 HG23 HD21 ' A' ' 117' ' ' LEU . 2.0 m -63.69 -15.13 57.62 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 175.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -115.58 -32.98 5.37 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.449 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.789 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 71.3 t -59.86 -53.78 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.77 -178.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 32.6 t-80 -73.65 74.53 1.52 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 121.001 0.429 . . . . 0.0 110.499 178.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.571 ' HB2' ' HA ' ' A' ' 106' ' ' SER . 23.2 pttm -71.65 145.83 48.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.98 176.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.692 ' HG3' ' H ' ' A' ' 104' ' ' GLU . 5.8 pt-20 -151.86 -78.4 0.12 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.842 174.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.692 ' H ' ' HG3' ' A' ' 103' ' ' GLU . 11.5 pt-20 -87.06 14.26 7.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.596 0.713 . . . . 0.0 110.066 176.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 179.42 139.5 3.69 Favored Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 110.427 -1.069 . . . . 0.0 110.427 178.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.571 ' HA ' ' HB2' ' A' ' 102' ' ' LYS . 4.3 m -87.36 -41.35 13.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.484 0.659 . . . . 0.0 110.349 179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.436 ' H ' ' CD ' ' A' ' 107' ' ' GLU . 0.4 OUTLIER -95.11 -27.08 15.75 Favored 'General case' 0 N--CA 1.434 -1.23 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.021 -177.183 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -76.21 141.6 41.74 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.043 -177.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.578 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -88.58 118.41 69.36 Favored Pre-proline 0 CA--C 1.509 -0.625 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.818 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.419 ' O ' ' HG2' ' A' ' 112' ' ' MET . 7.4 Cg_exo -73.29 60.31 3.97 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.364 2.043 . . . . 0.0 111.68 177.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.66 77.33 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 122.114 0.959 . . . . 0.0 110.979 174.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 110' ' ' PRO . 8.0 ptt? -95.44 -59.1 1.95 Allowed 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 114.135 -1.393 . . . . 0.0 110.718 -178.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.418 ' H ' ' HG3' ' A' ' 112' ' ' MET . 40.3 m -160.59 118.58 2.51 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.499 ' O ' HG13 ' A' ' 118' ' ' ILE . 12.0 pt-20 -52.54 -37.02 56.79 Favored 'General case' 0 C--O 1.221 -0.444 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -172.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -66.3 -42.05 88.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.979 0.418 . . . . 0.0 110.471 -179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -75.35 -29.06 59.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.315 178.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.632 HD21 HG23 ' A' ' 98' ' ' THR . 13.8 tp -65.0 -38.54 91.3 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 173.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 114' ' ' GLU . 90.6 mt -62.07 -43.1 97.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.249 172.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -63.43 -34.96 78.88 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.084 0.469 . . . . 0.0 110.407 175.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -39.56 85.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.38 176.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.885 HD13 ' HA ' ' A' ' 94' ' ' SER . 78.5 mt -66.27 -41.78 89.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.429 0.633 . . . . 0.0 109.865 175.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.795 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 29.6 t70 -62.33 -44.25 96.92 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.666 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . 0.489 ' HA2' ' HD3' ' A' ' 126' ' ' ARG . . . -54.3 -34.37 53.86 Favored Glycine 0 C--N 1.334 0.46 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.998 176.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.923 HG21 HD12 ' A' ' 97' ' ' ILE . 39.0 t -59.07 -53.41 48.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 120.886 0.375 . . . . 0.0 110.196 172.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 62.7 mt -68.46 -0.77 5.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.618 -179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.795 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 21.9 mtp180 -103.43 -47.98 4.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.681 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -121.38 -38.23 2.81 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -173.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.538 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 5.0 m-20 -75.77 -16.49 60.12 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-O 121.192 0.52 . . . . 0.0 110.805 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.604 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.5 t70 -78.9 87.24 4.74 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 169.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.8 mmmt -74.88 -32.79 61.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.139 -168.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -87.98 -3.09 58.95 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.609 -176.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.604 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 18.7 m120 60.71 43.24 12.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.057 179.018 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.1 p30 -98.17 -12.58 21.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.358 -179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.68 4.29 89.05 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.462 -0.875 . . . . 0.0 112.335 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.497 ' HB2' HD22 ' A' ' 87' ' ' LEU . 59.2 m-85 -129.56 -179.85 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 175.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.582 HG22 ' HB2' ' A' ' 88' ' ' LEU . 8.9 tt -120.81 120.74 63.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.43 0.633 . . . . 0.0 110.142 174.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -97.22 -178.09 4.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 175.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.823 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 21.5 t80 -55.21 -49.04 72.97 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 123.413 0.446 . . . . 0.0 111.669 -172.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.64 -31.49 71.54 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 121.107 -0.237 . . . . 0.0 111.489 -174.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.55 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.7 mt-10 -68.69 -51.26 43.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.404 -176.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.823 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.8 p90 -74.98 -32.48 61.69 Favored 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.734 179.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -61.08 -45.45 94.68 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.956 0.408 . . . . 0.0 110.074 178.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -65.62 -30.15 70.83 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.22 177.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 8.0 t -82.67 -37.01 25.43 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.831 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.471 HD12 HE21 ' A' ' 146' ' ' GLN . 3.8 pp -82.52 -27.04 31.96 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.206 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.471 HE21 HD12 ' A' ' 145' ' ' LEU . 19.9 mm-40 . . . . . 0 C--O 1.246 0.873 0 CA-C-O 118.354 -0.832 . . . . 0.0 110.461 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.618 ' HE1' ' HA ' ' A' ' 72' ' ' LEU . 51.8 mtp . . . . . 0 CA--C 1.52 -0.177 0 CA-C-O 121.057 0.455 . . . . 0.0 111.605 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 3.9 m -91.44 152.91 44.11 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.738 177.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -52.58 -49.05 18.8 Favored 'Trans proline' 0 CA--C 1.531 0.37 0 C-N-CA 122.237 1.958 . . . . 0.0 113.698 -176.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.56 ' HA ' HE21 ' A' ' 73' ' ' GLN . 19.0 pt20 -60.42 -41.02 93.1 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.451 -175.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 68' ' ' SER . 12.9 pt-20 -75.74 -33.94 60.28 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.171 -0.468 . . . . 0.0 109.751 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.635 ' O ' ' HB3' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -64.95 -21.68 66.87 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.329 0.585 . . . . 0.0 111.309 -174.532 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.56 HE21 ' HA ' ' A' ' 70' ' ' GLN . 46.6 mt-30 -73.09 -43.47 61.76 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 175.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.59 -20.86 66.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.911 172.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.635 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 39.0 t60 -64.65 -44.1 91.51 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 120.856 0.36 . . . . 0.0 110.348 175.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.74 ' CD1' HG22 ' A' ' 100' ' ' VAL . 3.8 m-30 -66.34 -25.97 67.07 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.24 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.759 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.6 t80 -74.17 -53.75 9.2 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.297 177.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.759 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 28.4 mmmt -80.63 -12.72 59.46 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.331 -173.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.466 ' HG2' ' HA ' ' A' ' 96' ' ' ALA . 1.0 OUTLIER -45.51 -35.69 4.03 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.981 0.801 . . . . 0.0 112.244 -174.149 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.79 10.58 1.06 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.995 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.575 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 30.1 t70 -84.55 81.71 8.73 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.909 0.861 . . . . 0.0 110.337 -179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -99.31 -6.88 27.16 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.286 177.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -95.8 -14.52 23.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.614 -174.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 66.37 23.96 72.01 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 114.911 0.724 . . . . 0.0 114.911 172.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -84.47 3.54 35.84 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 118.299 1.049 . . . . 0.0 111.026 176.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.621 ' HA ' ' HZ ' ' A' ' 77' ' ' PHE . 29.2 m-80 59.52 28.0 17.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.531 -177.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.0 mt -148.99 167.45 25.77 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.958 177.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.534 ' HB2' HG22 ' A' ' 136' ' ' ILE . 13.0 mt -135.26 122.08 21.04 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.201 -179.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -103.67 -170.52 1.79 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 172.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -51.21 -38.67 40.85 Favored Glycine 0 CA--C 1.521 0.468 0 O-C-N 123.399 0.437 . . . . 0.0 113.978 -174.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.2 mt -67.75 -41.25 83.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.354 0.597 . . . . 0.0 111.09 -175.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.575 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 40.1 mt-10 -74.69 -45.79 42.05 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.624 0.726 . . . . 0.0 109.886 177.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.572 ' HB3' HG12 ' A' ' 97' ' ' ILE . 21.7 mt -63.92 -20.36 65.8 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 114.98 -1.009 . . . . 0.0 113.148 -172.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.769 ' HA ' HD13 ' A' ' 121' ' ' ILE . 53.4 p -53.53 -36.7 62.08 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.735 0.302 . . . . 0.0 111.624 -177.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -90.04 -33.4 16.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.035 0.445 . . . . 0.0 111.141 179.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.598 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -80.16 -47.47 14.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.738 -171.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.879 HD12 HG21 ' A' ' 124' ' ' VAL . 36.5 mm -59.44 -22.75 23.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.612 -174.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.835 HG23 HD21 ' A' ' 117' ' ' LEU . 18.5 m -58.88 -18.24 31.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.308 175.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.472 ' CE1' ' HB2' ' A' ' 109' ' ' ALA . 85.4 m-70 -113.96 -17.27 12.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.403 176.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.74 HG22 ' CD1' ' A' ' 76' ' ' TYR . 2.4 t -88.27 -51.6 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 112.138 -174.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.504 ' CD2' HG13 ' A' ' 120' ' ' ILE . 52.7 t60 -71.08 106.96 3.91 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.861 -177.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.46 ' HE2' ' O ' ' A' ' 144' ' ' SER . 67.6 mttm -60.6 141.21 56.94 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.094 179.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -162.64 -76.03 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 175.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.922 ' HB3' ' HB3' ' A' ' 110' ' ' PRO . 43.7 tt0 -99.89 -34.39 10.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.34 0.59 . . . . 0.0 109.623 173.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.505 ' H ' ' HG3' ' A' ' 110' ' ' PRO . . . -122.28 135.83 10.5 Favored Glycine 0 N--CA 1.441 -0.981 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.585 178.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.8 m -76.95 -44.92 29.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.073 0.463 . . . . 0.0 110.33 177.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -111.38 -32.13 6.82 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.977 178.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.404 ' O ' ' HD3' ' A' ' 110' ' ' PRO . 48.1 mt-30 -80.1 155.85 27.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.243 -176.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.472 ' HB2' ' CE1' ' A' ' 99' ' ' HIS . . . -80.85 111.52 24.14 Favored Pre-proline 0 CA--C 1.509 -0.624 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.496 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.922 ' HB3' ' HB3' ' A' ' 104' ' ' GLU . 2.8 Cg_endo -83.11 64.36 7.86 Favored 'Trans proline' 0 N--CA 1.439 -1.72 0 C-N-CA 122.03 1.82 . . . . 0.0 110.874 176.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 46.8 tp -63.08 81.8 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 122.002 0.906 . . . . 0.0 111.054 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.417 ' H ' ' HG2' ' A' ' 112' ' ' MET . 8.9 ptt? -89.62 -56.09 3.39 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.366 178.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 69.6 m -159.8 123.57 3.7 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 177.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.577 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.51 -40.86 65.74 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.742 -172.505 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 34.1 t70 -71.12 -39.88 71.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 -177.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -67.48 -37.15 82.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.355 0.598 . . . . 0.0 109.597 174.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.835 HD21 HG23 ' A' ' 98' ' ' THR . 11.9 tp -61.86 -32.87 73.26 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.048 177.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.577 HG13 ' O ' ' A' ' 114' ' ' GLU . 85.7 mt -62.78 -43.96 99.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.416 174.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.508 ' O ' ' HB2' ' A' ' 122' ' ' ASP . 16.6 m120 -69.02 -24.17 64.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.183 0.516 . . . . 0.0 110.607 176.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.504 HG13 ' CD2' ' A' ' 101' ' ' HIS . 1.1 mp -66.07 -39.0 83.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-O 121.575 0.702 . . . . 0.0 109.505 173.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.789 ' HA ' HG21 ' A' ' 97' ' ' ILE . 80.1 mt -68.5 -38.76 79.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.379 174.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.611 ' HB3' ' NH1' ' A' ' 126' ' ' ARG . 94.4 m-20 -53.41 -49.55 67.04 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.732 172.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.81 -34.23 36.76 Favored Glycine 0 CA--C 1.508 -0.354 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.981 178.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.879 HG21 HD12 ' A' ' 97' ' ' ILE . 76.7 t -68.0 -51.78 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-O 120.801 0.334 . . . . 0.0 110.939 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.426 HD21 HD12 ' A' ' 93' ' ' LEU . 54.6 mt -67.72 -11.47 58.44 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.948 -177.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.611 ' NH1' ' HB3' ' A' ' 122' ' ' ASP . 48.8 mtt180 -105.64 -32.18 8.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.5 -177.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -132.18 -44.62 0.94 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 -171.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.572 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 39.7 m-20 -71.62 -19.72 62.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 120.693 0.282 . . . . 0.0 111.468 -176.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.534 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 0.9 OUTLIER -77.06 99.72 5.43 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 167.422 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -80.87 -19.08 45.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.725 -0.671 . . . . 0.0 111.904 -170.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -100.91 -3.65 29.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.549 -171.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 66.68 33.06 6.59 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 123.427 0.454 . . . . 0.0 111.376 -177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -97.08 -8.77 29.46 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.108 0.48 . . . . 0.0 110.056 176.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . 0.413 ' C ' ' HD2' ' A' ' 135' ' ' TYR . . . 79.97 -8.56 50.3 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.946 176.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.413 ' HD2' ' C ' ' A' ' 134' ' ' GLY . 5.3 m-30 -115.58 167.09 11.21 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.563 HG22 HD21 ' A' ' 93' ' ' LEU . 8.1 tt -111.76 118.2 57.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.792 0.806 . . . . 0.0 110.436 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -88.13 168.84 12.43 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.067 177.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.819 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 17.0 t80 -50.43 -47.67 56.57 Favored 'General case' 0 C--O 1.226 -0.167 0 O-C-N 123.084 0.24 . . . . 0.0 110.406 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -66.14 -33.16 75.15 Favored 'General case' 0 C--O 1.226 -0.151 0 CA-C-O 120.757 0.313 . . . . 0.0 111.379 -178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.534 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 45.3 mt-10 -68.68 -54.86 13.69 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.444 -176.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.819 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 3.9 p90 -70.72 -30.54 67.1 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 119.875 -0.73 . . . . 0.0 110.49 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.667 ' O ' ' HG2' ' A' ' 146' ' ' GLN . . . -61.69 -50.23 73.3 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 176.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -63.82 -32.39 73.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.099 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.46 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 15.9 t -77.7 -28.59 51.05 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.385 -177.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.49 HD21 ' HG2' ' A' ' 73' ' ' GLN . 4.4 pp -89.59 -5.24 57.36 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 122.412 -0.18 . . . . 0.0 111.107 -179.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.667 ' HG2' ' O ' ' A' ' 142' ' ' ALA . 28.6 mm-40 . . . . . 0 C--O 1.247 0.965 0 CA-C-O 118.694 -0.669 . . . . 0.0 110.324 177.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.67 ' HB2' HD21 ' A' ' 72' ' ' LEU . 89.6 mmm . . . . . 0 N--CA 1.461 0.115 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.503 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -88.43 153.09 50.59 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-O 120.297 0.094 . . . . 0.0 111.196 -179.281 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -50.89 -44.02 43.94 Favored 'Trans proline' 0 N--CA 1.476 0.492 0 C-N-CA 123.307 2.671 . . . . 0.0 114.701 -170.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -59.48 -49.06 79.23 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.741 -174.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 68' ' ' SER . 1.0 OUTLIER -74.5 -26.27 59.9 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.586 175.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.67 HD21 ' HB2' ' A' ' 67' ' ' MET . 17.2 mt -63.34 -18.89 64.12 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.405 ' HB3' ' HE1' ' A' ' 141' ' ' PHE . 17.6 mt-30 -71.71 -45.43 61.85 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 172.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.0 tp -64.43 -21.02 66.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.566 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.581 ' HB3' ' O ' ' A' ' 72' ' ' LEU . 7.9 t60 -66.9 -40.31 87.67 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.106 177.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.615 ' HE2' HD21 ' A' ' 145' ' ' LEU . 5.9 m-30 -68.39 -32.99 73.46 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 178.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.545 ' HB2' ' CZ ' ' A' ' 141' ' ' PHE . 57.3 t80 -71.02 -51.17 26.94 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.66 -1.154 . . . . 0.0 110.296 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -80.56 -16.91 53.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.868 -175.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.0 tpp -44.35 -48.69 9.72 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.646 0.591 . . . . 0.0 112.404 -172.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.575 ' ND1' ' HA ' ' A' ' 92' ' ' GLU . 0.1 OUTLIER -130.68 10.22 5.11 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.88 -175.584 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.726 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 26.5 t70 -80.47 75.15 7.33 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.68 0.752 . . . . 0.0 110.005 179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -91.53 -15.27 28.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.122 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 24.6 p30 -76.41 -14.24 60.08 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 -177.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 62.82 30.57 77.49 Favored Glycine 0 C--N 1.334 0.443 0 CA-C-N 115.483 -0.78 . . . . 0.0 113.065 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -101.36 3.45 40.59 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 117.294 0.547 . . . . 0.0 111.229 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 64.15 34.51 10.98 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.335 0.588 . . . . 0.0 110.479 176.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.509 ' HB3' ' CD2' ' A' ' 135' ' ' TYR . 15.6 mt -157.23 158.33 35.96 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.88 178.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.526 HD11 ' HA ' ' A' ' 77' ' ' PHE . 88.3 mt -120.15 121.43 38.77 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.669 -0.242 . . . . 0.0 110.82 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.464 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 0.6 OUTLIER -92.24 -177.45 4.66 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.399 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -55.85 -37.09 68.36 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.295 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.464 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 26.0 mt -68.66 -47.75 65.73 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.141 0.496 . . . . 0.0 110.368 -177.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.726 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 45.2 mt-10 -64.11 -42.23 96.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.87 176.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.634 HD21 HG22 ' A' ' 136' ' ' ILE . 24.1 mt -66.55 -18.39 65.34 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.792 -175.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.639 ' HA ' HD13 ' A' ' 121' ' ' ILE . 46.4 t -57.1 -32.06 65.91 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.689 0.28 . . . . 0.0 111.048 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.3 m -91.88 -31.01 15.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.069 0.461 . . . . 0.0 111.188 178.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.57 -43.73 12.46 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.867 HD12 HG21 ' A' ' 124' ' ' VAL . 39.7 mm -64.77 -25.91 38.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -175.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.618 HG22 ' HB1' ' A' ' 109' ' ' ALA . 17.9 m -58.47 -20.27 43.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.724 174.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 68.3 m-70 -109.44 -27.07 9.66 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.98 173.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.768 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 38.4 t -67.48 -58.66 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 120.719 0.295 . . . . 0.0 111.173 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -82.21 70.52 9.16 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 121.364 0.602 . . . . 0.0 110.026 -177.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.639 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -66.48 135.23 53.94 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.569 179.458 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.518 ' H ' ' HG3' ' A' ' 110' ' ' PRO . 20.9 mm-40 -113.91 -49.79 2.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.322 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -91.74 -20.97 20.98 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -175.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -148.2 -142.2 3.61 Favored Glycine 0 CA--C 1.507 -0.461 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.567 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.2 t -123.05 -53.98 1.83 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 117.106 0.453 . . . . 0.0 110.437 178.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.11 -38.76 16.18 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-O 121.346 0.594 . . . . 0.0 110.113 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.433 HE21 ' HB3' ' A' ' 108' ' ' GLN . 2.7 pt20 -64.54 130.03 42.1 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.518 -173.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.618 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -73.88 121.44 85.19 Favored Pre-proline 0 CA--C 1.505 -0.762 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.703 174.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.518 ' HG3' ' H ' ' A' ' 103' ' ' GLU . 3.7 Cg_exo -78.19 65.99 8.37 Favored 'Trans proline' 0 N--CA 1.443 -1.486 0 C-N-CA 121.745 1.63 . . . . 0.0 111.228 177.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.62 81.82 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.864 0.84 . . . . 0.0 111.095 173.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.409 ' CG ' ' H ' ' A' ' 113' ' ' SER . 14.4 ptt? -98.23 -57.81 2.12 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.005 -178.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.409 ' H ' ' CG ' ' A' ' 112' ' ' MET . 73.6 m -162.39 124.58 2.76 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.516 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -54.25 -37.88 65.18 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.132 -173.939 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.78 -43.93 82.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.026 0.441 . . . . 0.0 110.662 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -67.08 -39.73 86.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.344 0.592 . . . . 0.0 109.932 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.574 HD13 HG23 ' A' ' 98' ' ' THR . 10.8 mt -62.66 -37.67 87.33 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.99 175.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 114' ' ' GLU . 63.6 mt -60.82 -42.98 94.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.032 0.444 . . . . 0.0 110.619 172.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -67.36 -29.81 69.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.222 0.534 . . . . 0.0 110.479 176.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.44 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.0 OUTLIER -65.57 -34.49 70.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.885 174.656 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.852 ' HA ' HG21 ' A' ' 97' ' ' ILE . 88.4 mt -67.26 -38.34 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.8 174.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.805 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 25.9 t70 -60.79 -46.0 92.21 Favored 'General case' 0 C--O 1.221 -0.412 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.232 176.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -51.56 -37.75 41.91 Favored Glycine 0 C--N 1.334 0.422 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.007 175.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.867 HG21 HD12 ' A' ' 97' ' ' ILE . 54.8 t -63.58 -51.04 75.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.743 0.306 . . . . 0.0 110.417 174.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 86.8 mt -65.02 -7.48 12.04 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.45 -177.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.805 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 13.6 mtm180 -106.42 -49.33 3.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.847 0.356 . . . . 0.0 110.791 179.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -113.13 -44.19 3.29 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -169.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.51 ' HB2' HG13 ' A' ' 124' ' ' VAL . 27.3 m-20 -71.8 -23.89 61.64 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.151 0.5 . . . . 0.0 110.028 -177.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.607 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 4.6 t70 -76.05 88.22 2.98 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 168.006 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.5 -21.51 57.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.477 -169.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -108.14 6.46 26.85 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.168 -170.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.459 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 44.1 m-80 58.41 38.96 25.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.884 175.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.9 p30 -96.74 -13.27 22.8 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.308 177.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 83.18 2.69 90.45 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.312 178.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.509 ' CD2' ' HB3' ' A' ' 87' ' ' LEU . 28.5 m-85 -124.7 173.43 8.55 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.634 HG22 HD21 ' A' ' 93' ' ' LEU . 6.7 tt -116.18 123.41 71.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 172.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.424 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 1.5 p30 -101.03 -179.69 4.12 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 175.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.837 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 4.3 t80 -53.65 -50.31 66.05 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 123.558 0.537 . . . . 0.0 111.209 -174.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.63 -20.43 64.47 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.68 -176.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.607 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 49.4 mt-10 -80.12 -52.92 7.19 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 -176.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.837 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 6.0 p90 -70.14 -33.31 71.63 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.274 178.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -60.37 -41.23 93.29 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 120.845 0.355 . . . . 0.0 110.732 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.447 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 31.7 mtmm -70.69 -28.44 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.931 176.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.443 ' O ' ' HE3' ' A' ' 102' ' ' LYS . 14.9 t -80.87 -17.33 51.03 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -175.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.767 ' HG ' ' O ' ' A' ' 141' ' ' PHE . 85.8 mt -89.45 0.54 56.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.419 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.063 178.685 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.681 ' HB2' HD21 ' A' ' 72' ' ' LEU . 94.0 mmm . . . . . 0 N--CA 1.467 0.388 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -92.17 158.38 39.33 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-O 119.635 -0.221 . . . . 0.0 110.48 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.601 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 9.6 Cg_endo -52.34 -43.34 54.64 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.904 2.403 . . . . 0.0 113.618 -173.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.25 -54.03 51.38 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.933 -175.129 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.8 pm0 -72.36 -28.76 63.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.679 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.786 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 25.7 mt -63.87 -19.7 65.27 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 120.965 0.412 . . . . 0.0 110.938 178.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.782 ' HG2' HD21 ' A' ' 145' ' ' LEU . 17.8 mt-30 -66.15 -39.32 89.72 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 174.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.529 ' HG ' ' HG2' ' A' ' 78' ' ' LYS . 30.8 tp -77.22 -19.17 57.03 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.835 173.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.786 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 19.7 t60 -73.32 -38.67 65.74 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.68 ' CD2' HG22 ' A' ' 100' ' ' VAL . 6.9 m-30 -68.14 -41.61 81.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.035 175.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.664 ' HD2' ' HD2' ' A' ' 78' ' ' LYS . 50.0 t80 -66.37 -52.64 44.7 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.522 -175.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.664 ' HD2' ' HD2' ' A' ' 77' ' ' PHE . 27.6 mmmt -77.71 -15.77 58.92 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.989 -175.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.415 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 35.4 tpp -45.39 -44.87 12.28 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 123.84 0.712 . . . . 0.0 111.883 -175.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.542 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -132.48 7.68 4.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.404 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.512 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 24.0 t70 -92.75 85.35 5.19 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.832 0.825 . . . . 0.0 109.487 178.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.542 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 23.0 m-85 -96.64 -8.89 30.48 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.209 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -88.63 -16.37 32.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.732 -175.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 59.72 28.17 65.13 Favored Glycine 0 CA--C 1.524 0.637 0 CA-C-N 115.886 -0.597 . . . . 0.0 113.764 176.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.45 ' O ' ' HB3' ' A' ' 86' ' ' ASN . 18.9 p-10 -95.44 18.1 13.31 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 117.412 0.606 . . . . 0.0 111.5 -174.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 85' ' ' ASN . 4.3 t-20 76.48 -27.09 0.18 Allowed 'General case' 0 N--CA 1.47 0.557 0 O-C-N 123.782 0.676 . . . . 0.0 112.046 175.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 135' ' ' TYR . 2.6 mm? -112.81 162.63 15.57 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 122.105 0.955 . . . . 0.0 112.459 -176.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.507 HD21 ' HB2' ' A' ' 81' ' ' ASP . 1.3 mt -132.26 123.38 26.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.224 -1.353 . . . . 0.0 109.612 175.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.433 ' OD1' ' HG ' ' A' ' 91' ' ' LEU . 2.0 p-10 -96.25 175.44 6.44 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 175.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.41 -37.32 12.14 Favored Glycine 0 CA--C 1.526 0.739 0 N-CA-C 114.108 0.403 . . . . 0.0 114.108 -178.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.433 ' HG ' ' OD1' ' A' ' 89' ' ' ASP . 54.6 mt -65.13 -52.52 54.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.468 0.634 . . . . 0.0 110.707 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.512 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 43.9 mt-10 -61.47 -54.67 40.38 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.307 1.051 . . . . 0.0 109.33 174.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.995 ' HG ' HG12 ' A' ' 97' ' ' ILE . 5.5 tp -66.45 -9.82 37.99 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 113.836 -1.529 . . . . 0.0 112.917 -166.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 1.065 ' HA ' HD13 ' A' ' 121' ' ' ILE . 58.8 p -56.13 -45.32 79.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.72 0.295 . . . . 0.0 111.343 179.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.16 -23.53 51.6 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.218 0.532 . . . . 0.0 111.188 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.588 ' O ' HG23 ' A' ' 100' ' ' VAL . . . -86.42 -58.38 2.64 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.37 -175.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.995 HG12 ' HG ' ' A' ' 93' ' ' LEU . 24.4 mm -61.85 -20.36 23.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.281 -172.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.788 HG23 HD21 ' A' ' 117' ' ' LEU . 99.3 m -53.33 -31.52 44.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.081 0.467 . . . . 0.0 110.832 173.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 57.3 m-70 -94.82 -37.16 11.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.112 0.482 . . . . 0.0 110.823 176.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.939 HG21 ' HE1' ' A' ' 141' ' ' PHE . 2.1 t -72.57 -50.93 31.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.033 -170.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.582 ' CD2' HG13 ' A' ' 120' ' ' ILE . 12.7 t60 -78.6 69.76 4.84 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 106' ' ' SER . 35.4 pttt -64.7 86.29 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.012 -0.995 . . . . 0.0 111.893 -177.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.489 ' HG3' ' HG3' ' A' ' 104' ' ' GLU . 13.1 tp10 -67.36 -61.0 2.12 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.242 177.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.489 ' HG3' ' HG3' ' A' ' 103' ' ' GLU . 41.1 mt-10 -124.74 56.29 1.31 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.083 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -171.35 -166.16 29.72 Favored Glycine 0 N--CA 1.447 -0.63 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.448 ' O ' ' HD3' ' A' ' 102' ' ' LYS . 9.7 t -126.68 -91.78 0.51 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.885 0.343 . . . . 0.0 110.252 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -93.26 -27.95 16.53 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 121.858 0.837 . . . . 0.0 109.554 -178.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -86.18 163.46 17.79 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.565 -178.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.57 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -78.08 117.94 69.12 Favored Pre-proline 0 CA--C 1.506 -0.737 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.012 -174.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.57 ' HD2' ' O ' ' A' ' 98' ' ' THR . 59.1 Cg_endo -77.78 67.37 7.97 Favored 'Trans proline' 0 N--CA 1.445 -1.373 0 C-N-CA 121.422 1.415 . . . . 0.0 111.492 174.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.55 80.69 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.141 0 CA-C-O 121.886 0.85 . . . . 0.0 111.33 173.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.437 ' H ' ' HG2' ' A' ' 112' ' ' MET . 12.2 ptt? -86.59 -56.81 3.25 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.244 179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.0 m -163.7 126.36 2.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 177.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.423 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -51.15 -38.91 54.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.919 -1.037 . . . . 0.0 112.554 -174.052 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.3 -50.44 65.68 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.048 0.451 . . . . 0.0 111.068 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -64.61 -35.05 79.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.524 0.678 . . . . 0.0 109.946 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.788 HD21 HG23 ' A' ' 98' ' ' THR . 15.7 tp -65.09 -41.62 94.82 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.368 178.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 114' ' ' GLU . 55.0 mt -61.56 -42.1 92.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.581 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.429 ' O ' ' HB3' ' A' ' 122' ' ' ASP . 91.8 m-20 -71.62 -23.92 61.79 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.218 0.533 . . . . 0.0 110.71 176.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.582 HG13 ' CD2' ' A' ' 101' ' ' HIS . 0.9 OUTLIER -68.31 -33.66 61.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 121.303 0.573 . . . . 0.0 109.935 174.065 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 1.065 HD13 ' HA ' ' A' ' 94' ' ' SER . 58.8 mt -75.16 -17.69 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-O 121.636 0.731 . . . . 0.0 109.861 174.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.68 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 19.9 t70 -75.44 -36.76 60.69 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.37 -37.27 80.65 Favored Glycine 0 N--CA 1.449 -0.487 0 CA-C-N 114.671 -1.15 . . . . 0.0 113.148 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.669 HG12 ' O ' ' A' ' 121' ' ' ILE . 7.2 p -60.46 -43.34 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 CA-C-N 117.555 0.677 . . . . 0.0 109.97 177.126 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 44.0 mt -69.24 -13.82 62.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.082 -178.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.68 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 28.6 mtm-85 -99.22 -50.1 4.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.563 -178.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -119.07 -20.98 7.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -168.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.569 ' HB2' HG23 ' A' ' 124' ' ' VAL . 41.5 m-20 -89.89 -27.89 19.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.423 178.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.503 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 3.0 t70 -77.68 94.41 4.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.639 0.733 . . . . 0.0 109.316 172.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt -80.42 -32.38 37.4 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.217 -0.902 . . . . 0.0 111.462 -171.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -88.1 -0.18 56.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.676 -175.263 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.503 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 73.5 m-20 63.88 28.08 14.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.7 176.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 43.8 p30 -84.06 -13.58 52.73 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.305 -0.558 . . . . 0.0 109.993 179.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 86.26 1.36 86.29 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.561 176.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.574 ' HB2' HD12 ' A' ' 87' ' ' LEU . 33.4 m-85 -130.54 176.41 8.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.458 HD12 ' CG2' ' A' ' 124' ' ' VAL . 6.3 tt -111.01 123.57 67.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.269 174.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.97 167.79 11.38 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.489 -0.778 . . . . 0.0 108.963 173.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.403 ' HE1' ' HA ' ' A' ' 74' ' ' LEU . 11.2 t80 -51.9 -41.2 61.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.605 0.184 . . . . 0.0 111.397 -178.108 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -63.78 -44.58 92.96 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.733 0.301 . . . . 0.0 110.693 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.464 ' OE1' ' HA ' ' A' ' 129' ' ' ASP . 46.5 mt-10 -67.13 -41.47 86.07 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.939 ' HE1' HG21 ' A' ' 100' ' ' VAL . 0.0 OUTLIER -59.99 -54.77 42.12 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.496 178.013 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.633 ' O ' ' HG2' ' A' ' 146' ' ' GLN . . . -57.34 -47.04 82.61 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.875 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -65.38 -34.52 78.5 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.854 -178.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 36.8 t -75.36 -29.75 59.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.939 0.4 . . . . 0.0 110.65 -177.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.782 HD21 ' HG2' ' A' ' 73' ' ' GLN . 3.9 pp -86.77 -3.4 59.05 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.339 -178.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.633 ' HG2' ' O ' ' A' ' 142' ' ' ALA . 29.8 mm-40 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.394 177.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.605 ' HB2' ' CD2' ' A' ' 72' ' ' LEU . 97.3 mmm . . . . . 0 N--CA 1.471 0.576 0 CA-C-O 120.949 0.404 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.5 m -81.59 155.1 71.32 Favored Pre-proline 0 C--O 1.223 -0.329 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.656 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.454 ' O ' ' HG3' ' A' ' 73' ' ' GLN . 53.4 Cg_exo -53.97 -51.39 10.81 Favored 'Trans proline' 0 N--CA 1.477 0.52 0 C-N-CA 122.659 2.239 . . . . 0.0 114.609 -173.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -67.2 -35.85 80.48 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.34 0.59 . . . . 0.0 110.358 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.486 ' HG2' ' CE ' ' A' ' 67' ' ' MET . 5.5 tp10 -58.04 -53.3 59.85 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-N 115.087 -0.96 . . . . 0.0 108.928 173.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.662 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 24.3 mt -58.07 -23.26 53.93 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 113.808 -1.542 . . . . 0.0 112.933 -175.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 69' ' ' PRO . 13.7 mt-30 -70.93 -41.74 70.79 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 175.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.3 tp -66.56 -25.53 66.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.141 171.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.662 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 11.3 t60 -64.38 -40.68 96.29 Favored 'General case' 0 C--O 1.219 -0.53 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.08 174.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.5 ' OH ' ' HB3' ' A' ' 99' ' ' HIS . 3.6 m-30 -67.93 -30.72 70.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.235 0.54 . . . . 0.0 109.995 177.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.688 ' HD1' ' HD2' ' A' ' 78' ' ' LYS . 34.4 t80 -69.43 -51.83 32.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.762 177.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.688 ' HD2' ' HD1' ' A' ' 77' ' ' PHE . 26.4 mmmt -79.36 -12.51 59.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.412 -176.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 3.4 tpt -44.88 -36.83 3.51 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.989 0.915 . . . . 0.0 112.688 -172.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.518 ' HA ' ' CE2' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -147.57 10.23 0.95 Allowed 'General case' 0 C--N 1.316 -0.861 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.867 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.732 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 28.6 t70 -86.38 88.22 7.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.319 0.58 . . . . 0.0 110.396 -178.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.518 ' CE2' ' HA ' ' A' ' 80' ' ' HIS . 29.0 m-85 -112.02 -0.92 15.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.944 178.48 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 28.9 p30 -85.12 -13.82 49.02 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.043 -171.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 74.69 13.95 81.71 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 121.167 -0.54 . . . . 0.0 113.363 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.4 p-10 -92.97 -5.29 51.02 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 117.712 0.756 . . . . 0.0 110.781 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 62.47 20.01 11.6 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.596 176.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.51 HD12 ' HB2' ' A' ' 135' ' ' TYR . 1.3 mm? -132.32 153.18 50.98 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.492 -0.777 . . . . 0.0 109.212 174.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.719 ' HB2' HG22 ' A' ' 136' ' ' ILE . 3.9 mm? -106.59 114.53 28.69 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.173 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.498 ' OD2' ' HG3' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -93.77 -178.91 4.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.3 178.819 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -53.09 -51.04 48.91 Favored Glycine 0 N--CA 1.453 -0.218 0 N-CA-C 114.309 0.484 . . . . 0.0 114.309 -176.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.609 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.4 pp -73.8 -28.45 61.65 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.115 0.457 . . . . 0.0 110.875 -174.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.732 ' OE2' ' HA ' ' A' ' 81' ' ' ASP . 50.4 mt-10 -66.68 -52.15 48.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.861 ' HB3' HG12 ' A' ' 97' ' ' ILE . 30.3 mt -66.71 -7.38 20.53 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.95 -1.023 . . . . 0.0 112.393 -177.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.729 ' HA ' HD13 ' A' ' 121' ' ' ILE . 75.4 m -56.84 -31.77 65.09 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.717 -0.219 . . . . 0.0 111.109 176.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.6 m -91.61 -32.17 15.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.074 0.464 . . . . 0.0 111.15 175.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -84.29 -41.7 16.57 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.226 -169.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.885 ' HB ' HG12 ' A' ' 121' ' ' ILE . 40.2 mm -68.05 -17.85 22.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.102 0.477 . . . . 0.0 110.865 -177.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.835 HG23 HD13 ' A' ' 117' ' ' LEU . 4.7 m -60.01 -25.91 65.66 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.166 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.5 ' HB3' ' OH ' ' A' ' 76' ' ' TYR . 62.2 m-70 -103.5 -33.56 9.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.663 175.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.829 ' HB ' ' HA ' ' A' ' 97' ' ' ILE . 32.6 t -58.59 -51.41 72.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.763 177.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -70.61 85.62 0.64 Allowed 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.869 167.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 105' ' ' GLY . 0.0 OUTLIER -81.11 161.2 24.22 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 174.93 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -151.57 -84.9 0.08 Allowed 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.963 -177.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -75.65 -25.9 57.24 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.446 0.641 . . . . 0.0 110.012 178.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . 0.654 ' HA3' ' HG2' ' A' ' 108' ' ' GLN . . . -129.94 172.35 20.14 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.933 -1.267 . . . . 0.0 109.933 172.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.436 ' HA ' ' HB2' ' A' ' 102' ' ' LYS . 11.2 m -100.37 -46.89 5.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 117.694 0.747 . . . . 0.0 110.341 -179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.48 ' H ' ' CD ' ' A' ' 107' ' ' GLU . 0.8 OUTLIER -88.15 -31.54 19.1 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.443 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.654 ' HG2' ' HA3' ' A' ' 105' ' ' GLY . 20.0 pt20 -77.82 138.11 38.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.11 0.481 . . . . 0.0 110.775 -178.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.572 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -77.3 124.17 87.01 Favored Pre-proline 0 CA--C 1.507 -0.689 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.198 176.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 98' ' ' THR . 53.4 Cg_endo -79.65 65.67 8.86 Favored 'Trans proline' 0 N--CA 1.441 -1.56 0 C-N-CA 121.552 1.501 . . . . 0.0 111.323 175.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 94.6 mt -49.84 94.78 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.505 175.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -106.94 -47.78 3.63 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.064 -179.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 10.4 m 179.99 117.96 0.05 Allowed 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -177.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.538 ' O ' HG13 ' A' ' 118' ' ' ILE . 16.3 pt-20 -56.76 -36.69 70.1 Favored 'General case' 0 C--O 1.22 -0.495 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.794 -175.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -66.78 -45.63 77.84 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.833 0.349 . . . . 0.0 110.182 -179.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -63.09 -44.32 96.05 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.644 0.735 . . . . 0.0 109.888 177.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.835 HD13 HG23 ' A' ' 98' ' ' THR . 11.7 mt -60.23 -37.7 81.13 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 114.699 -1.137 . . . . 0.0 111.521 176.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.705 ' HA ' HD12 ' A' ' 121' ' ' ILE . 61.8 mt -61.07 -37.34 77.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.839 0.352 . . . . 0.0 110.91 174.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 11.3 m120 -65.38 -38.14 89.14 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.477 0.656 . . . . 0.0 109.266 174.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.417 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.2 mp -61.57 -42.16 92.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.765 174.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.885 HG12 ' HB ' ' A' ' 97' ' ' ILE . 93.3 mt -60.52 -36.93 73.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.603 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.829 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 33.9 t70 -61.31 -43.64 98.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -57.59 -29.04 60.52 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.718 177.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.799 HG21 HD12 ' A' ' 97' ' ' ILE . 79.1 t -65.01 -53.81 36.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 120.494 0.187 . . . . 0.0 110.759 174.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 67.4 mt -65.65 -14.11 60.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.007 0.432 . . . . 0.0 111.37 -175.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.829 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 15.9 mtp85 -103.66 -36.0 8.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.105 -177.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -124.08 -47.08 1.92 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 -170.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.583 ' HB3' HG13 ' A' ' 124' ' ' VAL . 12.6 t70 -71.91 -19.29 61.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 121.77 0.795 . . . . 0.0 109.809 -178.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.536 ' OD1' ' HA ' ' A' ' 132' ' ' ASN . 1.6 t70 -72.56 90.85 1.37 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.689 166.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 23.4 mmmt -79.19 -27.9 42.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.214 -170.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -88.26 -3.66 58.82 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.76 -176.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.536 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 14.1 t30 61.65 49.48 4.98 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.586 0.708 . . . . 0.0 110.727 179.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 52.8 p30 -107.62 -8.29 16.19 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.516 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 82.37 1.31 90.41 Favored Glycine 0 C--N 1.329 0.183 0 C-N-CA 121.008 -0.615 . . . . 0.0 113.055 175.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.51 ' HB2' HD12 ' A' ' 87' ' ' LEU . 50.4 m-85 -131.21 178.02 7.02 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 174.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.719 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.1 tt -114.97 126.21 72.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.217 0.532 . . . . 0.0 109.607 175.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -102.78 -178.22 3.61 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.704 175.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.835 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 44.1 t80 -56.75 -46.91 81.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 123.341 0.4 . . . . 0.0 111.598 -172.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -68.2 -28.27 67.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.646 0.26 . . . . 0.0 111.344 -176.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.496 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.5 mt-10 -72.74 -56.37 5.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.231 -175.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.835 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.9 p90 -70.6 -27.72 64.3 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.159 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -64.52 -34.24 77.76 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.337 179.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.418 ' HB2' ' HE3' ' A' ' 143' ' ' LYS . 47.4 mtmt -76.7 -32.61 57.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.374 177.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.551 ' OG ' ' HA ' ' A' ' 141' ' ' PHE . 1.3 p -82.27 -30.36 30.68 Favored 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.572 -174.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 4.5 pp -78.37 0.79 24.23 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.046 0.45 . . . . 0.0 110.512 178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.198 175.15 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.565 ' HB2' HD21 ' A' ' 72' ' ' LEU . 92.3 mmm . . . . . 0 N--CA 1.466 0.375 0 CA-C-O 120.944 0.402 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.49 ' HB3' ' HD2' ' A' ' 69' ' ' PRO . 6.3 m -76.4 160.7 77.0 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.143 -178.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.49 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 9.9 Cg_endo -52.79 -43.69 53.97 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.928 2.418 . . . . 0.0 112.693 -178.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.414 ' HG3' ' H ' ' A' ' 71' ' ' GLU . 6.9 pt20 -56.98 -48.37 78.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.531 178.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.414 ' H ' ' HG3' ' A' ' 70' ' ' GLN . 3.8 mm-40 -59.61 -52.97 63.26 Favored 'General case' 0 CA--C 1.503 -0.834 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.502 175.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.588 ' HA ' ' HB3' ' A' ' 75' ' ' HIS . 24.3 mt -60.38 -21.68 62.44 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.371 -0.831 . . . . 0.0 113.184 -166.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLN . . . . . 0.565 ' HG2' HD21 ' A' ' 145' ' ' LEU . 76.8 mt-30 -70.34 -46.2 64.62 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 174.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.9 tp -66.15 -22.36 66.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.831 172.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.588 ' HB3' ' HA ' ' A' ' 72' ' ' LEU . 6.1 t60 -66.98 -42.97 84.19 Favored 'General case' 0 C--O 1.222 -0.369 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.717 ' CD2' HG22 ' A' ' 100' ' ' VAL . 4.3 m-30 -70.32 -31.47 68.79 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.359 0.599 . . . . 0.0 109.481 178.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.612 ' HD1' ' HE1' ' A' ' 141' ' ' PHE . 57.6 t80 -67.59 -53.28 29.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.347 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -80.62 -13.85 58.69 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.581 -177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.462 ' HB2' ' O ' ' A' ' 75' ' ' HIS . 1.6 tpt -44.23 -40.0 4.84 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.752 0.821 . . . . 0.0 112.401 -170.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.671 ' HA ' ' CE1' ' A' ' 82' ' ' TYR . 0.0 OUTLIER -146.49 10.41 1.09 Allowed 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.944 -179.656 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.625 ' HA ' ' OE2' ' A' ' 92' ' ' GLU . 15.4 t70 -84.63 85.15 7.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.408 0.623 . . . . 0.0 109.764 179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' TYR . . . . . 0.671 ' CE1' ' HA ' ' A' ' 80' ' ' HIS . 69.5 m-85 -104.14 -6.66 20.84 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.511 -177.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . . . . . . . . . 26.3 p30 -77.76 -13.86 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.203 0.525 . . . . 0.0 110.943 -178.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 67.34 26.86 73.47 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.554 -0.748 . . . . 0.0 113.161 177.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -99.98 -2.87 33.46 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 117.464 0.632 . . . . 0.0 110.462 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 63.12 31.89 15.53 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.349 178.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.547 HD22 ' HB2' ' A' ' 135' ' ' TYR . 15.8 mt -141.89 141.09 33.02 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.529 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.728 ' HB2' HG22 ' A' ' 136' ' ' ILE . 4.0 mm? -95.36 109.25 21.44 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.802 -179.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -83.95 161.88 20.64 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-N 115.483 -0.781 . . . . 0.0 109.784 175.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -47.96 -48.5 24.85 Favored Glycine 0 C--O 1.23 -0.15 0 CA-C-O 119.782 -0.455 . . . . 0.0 113.842 -178.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.723 HD12 ' N ' ' A' ' 92' ' ' GLU . 4.1 pp -68.48 -32.27 72.15 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 117.409 0.604 . . . . 0.0 111.592 -175.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.723 ' N ' HD12 ' A' ' 91' ' ' LEU . 50.4 mt-10 -71.25 -58.78 3.22 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 122.555 1.169 . . . . 0.0 108.272 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 1.118 ' HG ' HG12 ' A' ' 97' ' ' ILE . 12.3 tp -60.84 -11.5 7.96 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 112.897 -1.956 . . . . 0.0 111.466 -174.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.846 ' HA ' HD13 ' A' ' 121' ' ' ILE . 7.9 m -52.72 -32.28 42.13 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.448 0.699 . . . . 0.0 112.71 178.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.0 -35.2 15.66 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.958 178.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.714 ' HB3' HD12 ' A' ' 93' ' ' LEU . . . -75.36 -41.3 56.84 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.276 -170.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 1.118 HG12 ' HG ' ' A' ' 93' ' ' LEU . 26.8 mm -60.07 -19.89 18.77 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -174.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.692 HG23 HD21 ' A' ' 117' ' ' LEU . 4.4 m -55.25 -27.94 49.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.35 172.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . 58.6 m-70 -107.93 -18.08 13.89 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.929 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.717 HG22 ' CD2' ' A' ' 76' ' ' TYR . 2.3 t -84.99 -53.52 10.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.531 -174.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . 0.679 ' CD2' ' HB2' ' A' ' 103' ' ' GLU . 21.2 t60 -66.98 98.31 0.55 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 178.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.53 ' HB2' ' HA ' ' A' ' 106' ' ' SER . 22.1 pttm -75.43 77.93 2.49 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.662 0.744 . . . . 0.0 111.774 -179.024 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.679 ' HB2' ' CD2' ' A' ' 101' ' ' HIS . 10.3 tp10 -88.47 -48.09 7.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.342 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -96.2 -68.65 0.79 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.918 -178.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . -97.67 -153.71 29.18 Favored Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 110.113 -1.195 . . . . 0.0 110.113 170.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.53 ' HA ' ' HB2' ' A' ' 102' ' ' LYS . 49.4 m -106.02 -83.15 0.52 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 117.517 0.659 . . . . 0.0 110.154 174.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -76.15 -6.99 53.76 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.284 0.564 . . . . 0.0 110.689 173.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.467 ' O ' ' HD3' ' A' ' 110' ' ' PRO . 16.9 mt-30 -71.46 137.78 48.51 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.566 179.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.561 ' HB1' HG22 ' A' ' 98' ' ' THR . . . -83.31 111.85 34.41 Favored Pre-proline 0 CA--C 1.511 -0.521 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.572 173.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' PRO . . . . . 0.467 ' HD3' ' O ' ' A' ' 108' ' ' GLN . 2.3 Cg_endo -80.81 69.64 7.87 Favored 'Trans proline' 0 N--CA 1.441 -1.589 0 C-N-CA 121.795 1.663 . . . . 0.0 111.197 174.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 70.5 mt -63.9 75.34 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 122.015 0.912 . . . . 0.0 110.734 171.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.402 ' HG2' ' H ' ' A' ' 112' ' ' MET . 12.8 ptt? -95.26 -58.01 2.25 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.04 -178.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 13.7 m -160.99 127.24 3.93 Favored 'General case' 0 N--CA 1.446 -0.652 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 176.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.594 ' O ' HG13 ' A' ' 118' ' ' ILE . 0.0 OUTLIER -53.72 -38.38 64.26 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.805 -178.011 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.504 ' O ' ' HB ' ' A' ' 118' ' ' ILE . 20.7 t70 -64.8 -46.22 82.93 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.27 0.557 . . . . 0.0 110.861 -179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.57 -38.66 91.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.291 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.692 HD21 HG23 ' A' ' 98' ' ' THR . 6.7 tp -63.85 -32.12 73.53 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.004 -0.998 . . . . 0.0 110.309 178.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.594 HG13 ' O ' ' A' ' 114' ' ' GLU . 73.9 mt -59.36 -45.48 93.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.129 174.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -64.29 -38.17 90.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.3 0.572 . . . . 0.0 110.039 175.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.547 ' HB ' ' HA ' ' A' ' 117' ' ' LEU . 1.3 mp -58.51 -46.67 89.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.068 177.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.846 HD13 ' HA ' ' A' ' 94' ' ' SER . 71.4 mt -62.9 -45.49 98.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.878 0.37 . . . . 0.0 110.39 177.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.517 ' O ' ' HG3' ' A' ' 126' ' ' ARG . 22.6 t70 -57.77 -44.94 86.51 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.008 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -54.49 -32.12 52.52 Favored Glycine 0 N--CA 1.448 -0.56 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.691 177.516 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.944 HG21 HD12 ' A' ' 97' ' ' ILE . 46.2 t -65.3 -54.77 25.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 121.209 -0.196 . . . . 0.0 110.805 174.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 9.0 mp -67.92 -7.25 26.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.193 0.52 . . . . 0.0 111.441 -176.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 122' ' ' ASP . 9.9 mtt180 -107.74 -36.04 6.52 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.834 -178.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -127.12 -41.79 1.75 Allowed 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.54 ' HB2' ' HA ' ' A' ' 124' ' ' VAL . 1.3 m-20 -71.73 -18.47 62.14 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.497 0.665 . . . . 0.0 110.22 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.596 ' HA ' ' OE2' ' A' ' 140' ' ' GLU . 2.2 t70 -77.81 93.12 4.29 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 165.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -79.09 -21.46 46.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.039 -169.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -92.63 -4.54 53.17 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.709 -176.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ASN . . . . . 0.421 ' HA ' ' OD1' ' A' ' 129' ' ' ASP . 20.3 m120 61.25 34.78 18.52 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.379 -177.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -93.42 -15.16 25.93 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.767 -177.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 92.3 -2.89 75.34 Favored Glycine 0 N--CA 1.453 -0.17 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.965 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' TYR . . . . . 0.547 ' HB2' HD22 ' A' ' 87' ' ' LEU . 45.5 m-85 -129.35 164.86 22.67 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 120.971 0.415 . . . . 0.0 110.005 178.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.728 HG22 ' HB2' ' A' ' 88' ' ' LEU . 6.4 tt -106.34 126.59 62.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.509 175.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.575 ' OD1' ' HG3' ' A' ' 140' ' ' GLU . 0.2 OUTLIER -103.23 178.96 4.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 177.304 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' TYR . . . . . 0.811 ' HA ' ' CZ ' ' A' ' 141' ' ' PHE . 2.9 t80 -53.02 -48.02 67.88 Favored 'General case' 0 C--N 1.327 -0.377 0 O-C-N 123.363 0.414 . . . . 0.0 111.264 -176.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -67.65 -30.02 69.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.963 0.411 . . . . 0.0 111.491 -176.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . 0.596 ' OE2' ' HA ' ' A' ' 129' ' ' ASP . 52.1 mt-10 -73.92 -50.79 18.47 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.251 -177.149 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' PHE . . . . . 0.811 ' CZ ' ' HA ' ' A' ' 138' ' ' TYR . 1.4 p90 -74.7 -25.49 59.18 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 119.669 -0.812 . . . . 0.0 110.596 178.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -58.97 -43.03 91.31 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 121.129 0.49 . . . . 0.0 110.102 175.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.421 ' HB2' ' HE2' ' A' ' 143' ' ' LYS . 34.5 mtmm -74.72 -28.44 60.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.745 176.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' SER . . . . . 0.469 ' O ' ' HG2' ' A' ' 102' ' ' LYS . 23.2 t -78.55 -43.04 27.64 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.065 -171.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.606 HD12 HE21 ' A' ' 146' ' ' GLN . 2.8 pp -84.24 -7.4 59.35 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.943 0.401 . . . . 0.0 111.387 -175.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.606 HE21 HD12 ' A' ' 145' ' ' LEU . 23.8 mm-40 . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.833 -178.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 1147 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 1148 ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_