data_2b7v_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 2b7v _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo . . . . . 0 C--O 1.235 0.341 0 N-CA-C 114.862 1.062 . . . . 0.0 114.862 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 71.8 t -55.09 -51.53 53.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.33 -44.26 75.69 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.072 1.349 . . . . 0.0 114.386 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mt -58.23 -57.76 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 123.829 0.851 . . . . 0.0 112.148 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -55.32 -38.54 68.84 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.601 0.715 . . . . 0.0 112.304 178.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -55.08 -61.31 2.4 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.152 1.781 . . . . 0.0 111.928 168.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -55.57 -56.47 19.99 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.05 -1.031 . . . . 0.0 113.179 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.6 mt -55.93 -29.16 59.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 117.504 2.409 . . . . 0.0 117.504 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.325 0.0 OUTLIER -9.21 75.92 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.757 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 -167.695 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -58.04 -34.55 98.55 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 122.022 1.815 . . . . 0.0 116.196 -165.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 177.55 30.12 0.04 OUTLIER Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.228 1.394 . . . . 0.0 112.123 172.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -96.51 164.14 12.74 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -161.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.12 141.28 45.96 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.634 1.574 . . . . 0.0 112.535 173.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -104.55 135.23 46.34 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.623 1.169 . . . . 0.0 111.764 -177.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -104.82 135.25 46.53 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.106 1.362 . . . . 0.0 109.685 164.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -104.43 119.94 40.1 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.103 0.954 . . . . 0.0 109.016 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 136.02 54.57 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 128.846 2.859 . . . . 0.0 106.57 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 C--N 1.318 -0.766 0 O-C-N 119.463 -2.023 . . . . 0.0 109.756 154.723 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 . . . . . 0 N--CA 1.445 -0.707 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.92 130.09 71.19 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 122.711 1.243 . . . . 0.0 109.875 -167.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 5.4 mmt -115.09 123.87 50.11 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.532 0.733 . . . . 0.0 110.333 177.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.88 136.58 44.11 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.931 0.892 . . . . 0.0 110.443 172.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.4 m -121.98 135.87 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.114 0.566 . . . . 0.0 112.397 167.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.9 t -104.47 128.54 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 161.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . 0.305 7.7 p -126.74 -110.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 124.626 1.17 . . . . 0.0 111.508 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -81.14 45.22 0.82 Allowed 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 121.189 1.813 . . . . 0.0 114.025 -168.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.4 13.99 80.89 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.935 -1.103 . . . . 0.0 112.07 -166.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -119.09 153.1 35.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 127.013 2.125 . . . . 0.0 109.981 -171.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -134.01 134.63 42.67 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.489 1.116 . . . . 0.0 111.712 -174.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -135.24 154.65 51.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.062 1.345 . . . . 0.0 111.287 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -134.74 134.81 41.4 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.133 2.173 . . . . 0.0 108.573 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.04 122.19 2.78 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 124.828 1.204 . . . . 0.0 111.901 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.6 p -105.68 114.55 28.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.554 1.142 . . . . 0.0 111.511 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.57 145.28 17.3 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.686 1.136 . . . . 0.0 115.818 -175.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.47 -24.13 0.47 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 172.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -158.25 177.67 11.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.91 1.684 . . . . 0.0 109.699 156.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.4 mtmm -49.28 -36.2 19.99 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 126.545 1.938 . . . . 0.0 115.149 177.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -13.08 1.26 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 170.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.6 tp -125.53 -42.71 1.93 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.884 2.074 . . . . 0.0 110.862 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -54.62 41.53 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.584 -1.322 . . . . 0.0 111.61 173.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.4 ttmt -55.48 -42.5 74.45 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.071 -1.442 . . . . 0.0 111.676 167.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.34 -51.42 66.81 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 121.238 1.836 . . . . 0.0 112.838 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -55.25 -56.33 21.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 129.495 3.118 . . . . 0.0 112.493 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.22 -53.54 54.79 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.836 1.254 . . . . 0.0 112.577 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.48 -56.46 9.69 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 126.409 1.884 . . . . 0.0 112.037 170.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -53.81 -48.0 70.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.697 1.599 . . . . 0.0 112.452 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.1 m -55.29 -57.92 9.84 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.581 1.152 . . . . 0.0 112.743 172.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -58.22 8.58 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.63 1.172 . . . . 0.0 111.762 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -40.23 -59.43 1.28 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.416 2.687 . . . . 0.0 110.86 173.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.81 -56.66 15.52 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.174 0.443 . . . . 0.0 111.489 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 93.0 m -55.25 -70.35 0.11 Allowed 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 176.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.259 12.0 m -55.46 -40.85 60.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -60.46 -40.24 90.47 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.166 -1.584 . . . . 0.0 114.212 170.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -35.14 65.23 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.262 1.392 . . . . 0.0 114.456 162.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt . . . . . 0 N--CA 1.481 1.094 0 CA-C-N 118.829 0.741 . . . . 0.0 112.999 169.548 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo . . . . . 0 C--O 1.234 0.307 0 N-CA-C 113.933 0.705 . . . . 0.0 113.933 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.4 t -55.18 -49.34 72.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -46.85 75.98 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.0 mt -55.85 -56.17 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 119.611 1.096 . . . . 0.0 111.212 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.436 HD23 ' HH ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -54.83 -43.73 73.26 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.127 0.971 . . . . 0.0 112.719 -179.672 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -56.22 -58.02 9.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 127.006 2.122 . . . . 0.0 112.501 172.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -55.21 -55.02 36.04 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.81 2.044 . . . . 0.0 112.359 177.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mt -55.97 -38.15 70.01 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 171.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.288 0.0 OUTLIER 24.11 65.39 0.4 Allowed Pre-proline 0 N--CA 1.488 1.459 0 C-N-CA 127.399 2.28 . . . . 0.0 115.156 -168.724 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.53 55.93 3.83 Favored 'Trans proline' 0 CA--C 1.549 1.249 0 C-N-CA 124.811 3.674 . . . . 0.0 113.566 -173.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 63.19 24.27 67.05 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 125.8 1.666 . . . . 0.0 115.431 173.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 pp -90.62 173.3 8.12 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.494 1.147 . . . . 0.0 112.998 -172.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -133.26 134.93 44.58 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.823 0.849 . . . . 0.0 111.19 169.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.436 ' HH ' HD23 ' A' ' 10' ' ' LEU . 10.5 m-85 -104.49 135.3 46.17 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.59 1.556 . . . . 0.0 109.888 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -123.3 135.53 54.26 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 126.822 2.049 . . . . 0.0 109.793 179.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -104.72 130.42 52.79 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 122.754 1.264 . . . . 0.0 111.906 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.08 157.35 47.16 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 129.617 3.167 . . . . 0.0 108.386 -171.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.4 p . . . . . 0 C--N 1.319 -0.73 0 C-N-CA 125.489 1.516 . . . . 0.0 111.656 172.842 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 104.038 -2.578 . . . . 0.0 104.038 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.6 t -115.17 130.32 69.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 122.153 0.978 . . . . 0.0 108.976 -168.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 52.7 mmm -117.03 119.45 35.32 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.513 0.725 . . . . 0.0 109.797 177.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.97 138.37 41.29 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.883 1.273 . . . . 0.0 110.207 177.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -133.14 136.0 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.28 -0.887 . . . . 0.0 111.866 -177.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.35 127.07 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 161.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.3 141.93 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.897 1.679 . . . . 0.0 108.787 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.7 t70 56.65 -79.92 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 126.225 1.81 . . . . 0.0 113.698 -173.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -161.75 24.99 0.24 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 129.049 3.214 . . . . 0.0 110.418 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -124.35 156.68 36.62 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.182 2.593 . . . . 0.0 109.05 -169.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -134.61 136.93 43.27 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.952 0.901 . . . . 0.0 111.4 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -135.1 159.54 41.2 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.17 0.988 . . . . 0.0 111.736 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -131.12 129.21 41.55 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.727 2.011 . . . . 0.0 108.388 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.77 117.86 3.02 Favored Glycine 0 C--O 1.227 -0.301 0 C-N-CA 124.828 1.204 . . . . 0.0 110.293 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 p -104.72 116.32 31.83 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.475 1.11 . . . . 0.0 109.421 -173.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -142.32 135.89 6.9 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 120.941 -1.1 . . . . 0.0 115.592 -179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.9 ttt85 -40.6 -22.9 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 170.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -153.53 -177.98 6.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.483 1.113 . . . . 0.0 111.16 147.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -49.24 -37.5 23.54 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 126.644 1.978 . . . . 0.0 114.797 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -13.91 1.69 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 171.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.6 tp -121.58 -44.48 2.34 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.99 2.116 . . . . 0.0 110.26 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.66 -57.19 13.01 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 125.666 1.586 . . . . 0.0 112.4 175.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -55.23 -44.28 75.32 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 116.507 -1.711 . . . . 0.0 110.936 168.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.57 -50.93 68.78 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 121.924 2.147 . . . . 0.0 112.741 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.6 mmm-85 -54.54 -58.6 6.86 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.146 2.178 . . . . 0.0 111.555 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.66 -54.16 47.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.941 0.897 . . . . 0.0 112.872 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.92 -55.85 15.19 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 126.88 2.072 . . . . 0.0 112.863 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -47.88 74.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 121.019 1.736 . . . . 0.0 111.406 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.0 m -55.05 -53.61 53.62 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.215 0.606 . . . . 0.0 112.049 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.06 -59.59 4.55 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.398 1.479 . . . . 0.0 111.734 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.43 -63.46 0.82 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 128.37 2.668 . . . . 0.0 110.627 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.95 -49.92 70.19 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.018 0.527 . . . . 0.0 111.082 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 46.4 m -55.24 -71.35 0.09 Allowed 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.276 11.4 m -55.59 -44.22 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.721 1.208 . . . . 0.0 114.062 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -55.97 -47.97 76.69 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 170.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -36.43 69.01 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.249 1.386 . . . . 0.0 113.903 168.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 124.405 1.082 . . . . 0.0 111.273 172.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo . . . . . 0 N--CA 1.461 -0.423 0 N-CA-C 113.607 0.58 . . . . 0.0 113.607 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 59.9 t -54.46 -52.95 34.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -55.91 -53.02 61.93 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 116.051 1.871 . . . . 0.0 116.051 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.1 pt -57.66 -48.21 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.27 0.941 . . . . 0.0 113.507 171.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -55.71 -41.51 73.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 174.455 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.13 -56.67 17.28 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.527 1.931 . . . . 0.0 111.804 171.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.274 1.8 pt-20 -57.39 -59.78 4.63 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 175.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -55.8 -33.71 64.66 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 176.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.277 0.0 OUTLIER 15.04 67.87 0.16 Allowed Pre-proline 0 N--CA 1.487 1.415 0 C-N-CA 129.523 3.129 . . . . 0.0 118.092 -175.633 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.17 43.14 0.09 OUTLIER 'Trans proline' 0 CA--C 1.558 1.683 1 C-N-CA 125.921 4.414 . . . . 0.0 118.848 -175.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.45 32.85 24.05 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 120.065 -1.647 . . . . 0.0 113.771 177.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -103.8 166.63 10.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -166.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -134.79 138.77 44.57 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.922 2.089 . . . . 0.0 111.692 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -104.54 135.26 46.29 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.715 1.206 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -118.51 135.27 54.49 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 127.619 2.368 . . . . 0.0 109.261 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -108.66 124.78 51.05 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 122.331 1.062 . . . . 0.0 111.874 -174.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -131.9 167.51 19.49 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 129.895 3.278 . . . . 0.0 106.309 -173.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.9 p . . . . . 0 C--N 1.321 -0.638 0 O-C-N 119.937 -1.727 . . . . 0.0 113.168 159.93 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 . . . . . 0 N--CA 1.457 -0.098 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.327 0.1 OUTLIER -107.53 135.02 47.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 122.745 1.26 . . . . 0.0 112.561 175.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 76.1 mmm -125.16 117.33 23.64 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.406 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.3 m -115.83 135.19 54.24 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.386 0.674 . . . . 0.0 109.709 -172.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -121.33 135.81 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.446 1.098 . . . . 0.0 112.067 -174.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.3 t -104.41 125.98 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 165.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.3 p -146.71 145.37 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 126.878 2.071 . . . . 0.0 109.095 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.5 t70 62.16 -23.66 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 130.62 3.78 4.52 Favored Glycine 0 CA--C 1.544 1.87 0 C-N-CA 126.569 2.033 . . . . 0.0 113.585 -167.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -135.02 165.7 24.74 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.192 2.197 . . . . 0.0 111.832 -173.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.23 137.22 44.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.365 1.066 . . . . 0.0 112.689 -163.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -135.03 150.72 50.35 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.131 1.773 . . . . 0.0 110.809 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.53 110.55 10.56 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.288 1.035 . . . . 0.0 110.557 -174.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.97 109.1 3.21 Favored Glycine 0 CA--C 1.527 0.792 0 C-N-CA 126.018 1.771 . . . . 0.0 112.018 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.0 m -108.02 104.94 14.49 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.052 0.926 . . . . 0.0 112.601 -172.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.45 136.46 7.89 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.832 1.682 . . . . 0.0 114.791 -172.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -13.63 -59.1 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 127.057 2.143 . . . . 0.0 116.739 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -136.94 177.2 8.05 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.067 1.747 . . . . 0.0 109.908 169.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -46.88 -46.01 20.82 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 120.015 1.28 . . . . 0.0 114.093 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.63 -23.43 1.7 Allowed 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 174.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -108.39 -40.19 5.21 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.235 1.414 . . . . 0.0 111.31 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.39 -56.83 15.63 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.694 1.197 . . . . 0.0 112.575 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt -55.41 -35.63 65.56 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 115.698 -2.096 . . . . 0.0 113.249 165.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.55 -54.81 39.36 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 122.501 2.41 . . . . 0.0 110.94 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -55.0 -53.26 58.04 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.305 2.242 . . . . 0.0 114.05 169.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.51 -56.67 17.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.225 1.01 . . . . 0.0 111.952 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.33 -60.07 2.55 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.291 1.036 . . . . 0.0 113.207 166.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -50.51 -48.43 57.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.336 1.454 . . . . 0.0 112.92 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.12 -59.16 5.15 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 112.486 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.17 -57.1 13.13 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.869 -1.062 . . . . 0.0 111.998 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -42.15 -64.32 0.61 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.288 2.635 . . . . 0.0 111.121 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.82 66.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.129 0.422 . . . . 0.0 111.092 -178.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 41.0 m -55.44 -73.17 0.06 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 175.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.253 11.6 m -55.52 -42.02 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.73 1.212 . . . . 0.0 113.845 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -56.63 -47.02 80.59 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.638 1.108 . . . . 0.0 113.4 169.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -55.3 -33.8 63.58 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 169.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt . . . . . 0 N--CA 1.479 1.018 0 CA-C-N 119.242 0.928 . . . . 0.0 110.746 167.567 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 CA--C 1.53 0.301 0 N-CA-C 114.58 0.954 . . . . 0.0 114.58 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.3 t -54.99 -50.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 122.152 0.977 . . . . 0.0 109.067 172.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.54 -49.99 71.19 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.258 10.7 pt -58.8 -48.89 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-N 120.653 1.569 . . . . 0.0 114.563 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.283 0.0 OUTLIER -55.53 -39.95 71.21 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.022 -1.049 . . . . 0.0 113.434 176.045 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -58.57 7.12 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.614 1.966 . . . . 0.0 112.117 167.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.8 -54.93 38.46 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.5 mt -55.9 -42.19 75.64 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.139 1.375 . . . . 0.0 114.584 172.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 27.38 65.17 0.59 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 128.369 2.668 . . . . 0.0 116.202 -171.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.97 74.74 0.05 OUTLIER 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 124.953 3.769 . . . . 0.0 117.117 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.86 35.15 89.73 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.691 1.615 . . . . 0.0 114.936 173.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 pp -111.81 157.46 20.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -154.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.78 141.09 44.74 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 127.419 2.288 . . . . 0.0 114.175 167.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -104.48 135.36 46.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.451 1.101 . . . . 0.0 111.44 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.58 135.43 48.12 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.909 2.083 . . . . 0.0 110.064 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -104.58 129.69 52.65 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 123.312 1.53 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -134.76 145.33 48.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 130.369 3.468 . . . . 0.0 105.944 -168.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.6 t . . . . . 0 C--N 1.317 -0.845 0 O-C-N 118.921 -2.362 . . . . 0.0 108.264 -171.971 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 . . . . . 0 CA--C 1.509 -0.624 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 98.0 t -118.07 134.88 60.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 123.3 1.524 . . . . 0.0 109.45 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.06 124.29 46.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 171.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.3 t -120.22 134.35 55.28 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.676 0.671 . . . . 0.0 111.139 169.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -121.51 135.63 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.548 0.739 . . . . 0.0 110.322 -169.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -94.85 114.27 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.2 t -138.52 137.0 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.596 1.958 . . . . 0.0 108.337 -168.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 t70 59.02 -66.34 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.75 2.02 . . . . 0.0 114.044 -170.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 18.97 0.06 OUTLIER Glycine 0 CA--C 1.542 1.737 0 C-N-CA 128.031 2.729 . . . . 0.0 112.692 170.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -135.21 165.11 26.17 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.931 2.492 . . . . 0.0 110.944 -168.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -127.01 128.68 46.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.756 0.822 . . . . 0.0 112.508 -162.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -135.11 103.3 5.5 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.445 1.098 . . . . 0.0 113.533 -164.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -77.84 135.26 37.9 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 127.605 2.362 . . . . 0.0 110.432 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.98 123.67 3.19 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 125.948 1.737 . . . . 0.0 110.34 174.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.2 t -113.63 113.01 24.45 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.817 0.847 . . . . 0.0 111.175 -173.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.74 149.91 20.17 Favored Glycine 0 CA--C 1.529 0.939 0 C-N-CA 125.387 1.47 . . . . 0.0 115.767 -174.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -53.32 -23.01 8.17 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 175.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -157.7 -174.82 5.05 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.94 1.696 . . . . 0.0 110.288 152.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -45.19 -49.24 12.31 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.993 1.717 . . . . 0.0 114.27 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -14.15 1.13 Allowed 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.5 tp -114.66 -41.31 3.43 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.334 1.854 . . . . 0.0 111.294 172.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -55.29 33.47 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.371 174.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt -55.35 -41.93 73.2 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-O 115.413 -2.232 . . . . 0.0 113.593 162.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -50.19 70.59 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 123.444 2.838 . . . . 0.0 111.17 -178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -54.99 -58.16 8.77 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 129.222 3.009 . . . . 0.0 113.259 168.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -56.38 20.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.673 1.189 . . . . 0.0 112.168 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -44.86 -60.33 2.1 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.271 1.428 . . . . 0.0 114.454 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -55.01 -45.45 75.1 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.794 1.179 . . . . 0.0 112.716 -177.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.48 -56.84 15.56 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.32 1.048 . . . . 0.0 112.507 171.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -59.35 4.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.62 1.168 . . . . 0.0 112.24 177.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -57.62 5.82 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.871 2.068 . . . . 0.0 111.884 178.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.97 -49.07 72.33 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.133 0.424 . . . . 0.0 111.331 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -55.28 -68.06 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.3 m -55.47 -46.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -177.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -55.94 -48.34 75.92 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 173.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -38.07 69.08 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.054 0.843 . . . . 0.0 112.556 170.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.549 0.929 0 C-N-CA 124.504 1.122 . . . . 0.0 110.181 168.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo . . . . . 0 C--O 1.236 0.414 0 N-CA-C 114.659 0.984 . . . . 0.0 114.659 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 95.5 t -54.78 -50.83 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -55.29 -44.45 75.74 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.993 1.317 . . . . 0.0 114.401 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.5 mt -55.92 -59.51 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 125.254 1.422 . . . . 0.0 112.316 168.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.402 ' CD1' ' HH ' ' A' ' 19' ' ' TYR 0.264 0.0 OUTLIER -55.54 -39.31 70.4 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.696 0.798 . . . . 0.0 112.447 -179.556 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.58 -57.71 10.8 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 127.538 2.335 . . . . 0.0 112.163 168.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -55.37 -58.05 9.34 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.601 1.56 . . . . 0.0 112.001 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 13.3 mt -55.82 -35.76 66.73 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.366 0.0 OUTLIER -10.11 90.71 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.238 0 C-N-CA 127.835 2.454 . . . . 0.0 117.387 -161.883 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -66.98 -166.1 0.11 Allowed 'Trans proline' 0 CA--C 1.549 1.234 0 C-N-CA 122.457 2.105 . . . . 0.0 111.544 169.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.43 66.04 0.4 Allowed Glycine 0 CA--C 1.539 1.547 0 O-C-N 120.631 -1.293 . . . . 0.0 114.117 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 pp -112.0 167.14 10.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.848 1.659 . . . . 0.0 113.343 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -135.23 138.87 43.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.54 1.536 . . . . 0.0 112.443 167.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.402 ' HH ' ' CD1' ' A' ' 10' ' ' LEU . 19.2 m-85 -104.25 135.24 46.09 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.353 1.073 . . . . 0.0 109.62 172.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -114.08 135.33 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 127.83 2.452 . . . . 0.0 108.568 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -107.04 119.65 39.96 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.351 1.072 . . . . 0.0 111.147 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.38 150.48 45.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 129.827 3.251 . . . . 0.0 106.808 -177.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.2 p . . . . . 0 C--N 1.321 -0.671 0 O-C-N 120.343 -1.473 . . . . 0.0 112.068 174.652 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 . . . . . 0 N--CA 1.447 -0.603 0 N-CA-C 103.994 -2.595 . . . . 0.0 103.994 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -116.49 114.16 45.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -158.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 72.9 mmm -104.72 118.49 36.7 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.2 m -123.72 135.29 53.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.819 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.27 135.88 53.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 123.714 0.806 . . . . 0.0 109.671 -158.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.0 t -104.13 112.85 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.0 t -137.96 136.35 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.893 2.077 . . . . 0.0 107.963 -164.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.1 t70 59.83 -65.62 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 127.213 2.205 . . . . 0.0 114.167 -171.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -174.92 20.66 0.05 OUTLIER Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.117 2.77 . . . . 0.0 112.033 174.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.09 166.84 22.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 127.248 2.219 . . . . 0.0 109.613 -167.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -121.87 138.53 54.36 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.995 0.918 . . . . 0.0 111.779 -175.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -134.77 148.3 50.2 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.083 1.753 . . . . 0.0 109.519 -173.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -133.94 131.49 39.09 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.618 1.167 . . . . 0.0 109.985 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -129.37 113.45 1.52 Allowed Glycine 0 CA--C 1.522 0.474 0 C-N-CA 125.077 1.322 . . . . 0.0 111.381 -173.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -104.81 104.69 14.51 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.115 0.966 . . . . 0.0 111.171 -172.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.01 137.97 9.54 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 124.496 1.046 . . . . 0.0 115.42 -176.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -35.76 -44.41 0.34 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 115.383 1.623 . . . . 0.0 115.383 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -139.97 179.19 6.75 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.292 1.037 . . . . 0.0 111.171 158.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -47.25 -35.1 7.25 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 126.589 1.955 . . . . 0.0 115.838 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.07 -15.4 5.21 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.5 tp -124.04 -41.74 2.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.267 2.227 . . . . 0.0 110.728 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.7 -58.27 8.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.967 1.307 . . . . 0.0 112.912 172.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -55.25 -46.34 76.08 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-O 116.886 -1.531 . . . . 0.0 110.127 169.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.59 75.0 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 121.594 1.997 . . . . 0.0 113.174 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -55.39 -57.5 11.61 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 170.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.93 49.92 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.489 0.716 . . . . 0.0 112.574 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.19 -59.11 4.25 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.635 2.374 . . . . 0.0 112.455 172.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.12 -49.42 71.82 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.998 1.272 . . . . 0.0 111.687 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.7 m -55.42 -55.07 35.87 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.029 0.932 . . . . 0.0 112.542 175.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -55.74 27.8 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.769 1.228 . . . . 0.0 111.841 175.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.42 -57.82 2.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.481 2.312 . . . . 0.0 110.68 175.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.87 -54.17 45.98 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 122.834 0.454 . . . . 0.0 111.638 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.3 m -55.15 -68.69 0.17 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.278 21.1 m -55.51 -46.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -57.74 -46.66 84.17 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.72 -36.79 67.62 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.391 1.45 . . . . 0.0 113.635 169.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.548 0.894 0 C-N-CA 124.864 1.265 . . . . 0.0 111.466 169.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo . . . . . 0 C--O 1.236 0.38 0 N-CA-C 115.275 1.221 . . . . 0.0 115.275 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 59.5 t -46.87 -58.59 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.117 0.967 . . . . 0.0 109.264 169.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.0 tpp -55.69 -43.91 76.85 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.7 1.6 . . . . 0.0 114.412 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.1 mt -55.59 -59.67 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.389 0.995 . . . . 0.0 110.928 173.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.28 -48.41 54.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.489 1.516 . . . . 0.0 111.236 176.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -57.89 -55.38 35.59 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 124.72 1.208 . . . . 0.0 113.881 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -56.45 -45.3 80.89 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.274 1.83 . . . . 0.0 113.765 174.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.58 -37.68 68.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.201 1.8 . . . . 0.0 112.951 169.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.8 ptt-85 34.8 66.4 1.49 Allowed Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 127.63 2.372 . . . . 0.0 114.412 -178.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.71 60.64 1.19 Allowed 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 124.922 3.748 . . . . 0.0 113.06 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.92 25.99 64.81 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.019 1.771 . . . . 0.0 115.064 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pp -79.06 162.05 26.15 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 116.432 2.012 . . . . 0.0 116.432 -159.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -135.21 137.18 42.39 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.303 2.241 . . . . 0.0 110.713 164.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -104.39 135.32 46.05 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 124.587 1.18 . . . . 0.0 111.465 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -121.28 135.57 55.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 127.614 2.366 . . . . 0.0 109.68 -177.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -104.49 124.16 48.78 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 122.772 1.272 . . . . 0.0 109.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -123.84 159.46 29.53 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 130.239 3.416 . . . . 0.0 103.645 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.6 p . . . . . 0 N--CA 1.473 0.711 0 O-C-N 118.753 -2.467 . . . . 0.0 112.847 167.309 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 N--CA 1.45 -0.457 0 CA-C-O 121.766 0.793 . . . . 0.0 109.607 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.258 0.1 OUTLIER -104.96 134.5 46.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 122.843 1.306 . . . . 0.0 111.768 167.38 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 67.1 mmm -117.76 127.13 53.61 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -122.96 135.24 54.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -119.58 135.71 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 111.076 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.8 t -102.25 124.67 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 104.87 -2.27 . . . . 0.0 104.87 161.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.8 m -138.29 150.28 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.936 2.094 . . . . 0.0 108.159 -173.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.2 t70 54.97 -79.28 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 125.204 1.401 . . . . 0.0 113.552 -175.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -159.67 20.9 0.27 Allowed Glycine 0 CA--C 1.544 1.844 0 C-N-CA 127.988 2.709 . . . . 0.0 112.5 167.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -135.13 170.29 16.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.834 2.453 . . . . 0.0 112.583 -172.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -134.5 136.44 43.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.92 0.888 . . . . 0.0 112.991 -162.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -134.98 149.6 50.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.049 1.74 . . . . 0.0 111.102 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -132.27 125.95 32.24 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.897 1.279 . . . . 0.0 109.846 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.05 112.91 2.12 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 126.019 1.771 . . . . 0.0 111.569 -169.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -104.9 112.84 26.12 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.432 1.116 . . . . 0.0 111.059 -170.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.69 136.42 8.46 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 125.694 1.616 . . . . 0.0 116.702 -165.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.1 mmm-85 -55.51 -13.81 1.72 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 170.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -152.88 165.59 34.96 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 128.186 2.594 . . . . 0.0 109.139 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -51.37 -42.83 61.63 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 121.158 1.799 . . . . 0.0 113.376 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -5.7 3.44 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 174.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.58 -50.93 3.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.214 1.406 . . . . 0.0 109.067 170.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.36 -59.4 4.85 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.594 1.958 . . . . 0.0 113.459 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt -55.53 -38.34 69.11 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 115.479 -2.2 . . . . 0.0 113.081 163.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 -50.77 68.89 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 123.462 2.847 . . . . 0.0 111.944 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -55.34 -58.25 8.49 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.269 3.428 . . . . 0.0 113.347 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.4 -56.31 21.6 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.066 1.347 . . . . 0.0 111.593 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.68 -55.28 11.77 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 168.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -55.1 -47.75 74.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 120.822 1.646 . . . . 0.0 112.911 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -55.12 -56.69 16.98 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.54 1.136 . . . . 0.0 112.298 172.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -55.04 35.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.638 1.175 . . . . 0.0 112.279 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.37 -60.83 2.36 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.762 2.425 . . . . 0.0 109.8 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.09 -48.45 73.55 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.774 0.43 . . . . 0.0 111.31 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.2 m -55.37 -69.3 0.14 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.772 1.026 . . . . 0.0 113.772 173.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.4 m -55.27 -41.33 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.287 0.948 . . . . 0.0 112.957 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.23 -45.24 80.05 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.82 -1.175 . . . . 0.0 113.724 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -36.53 67.2 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 164.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.4 mt . . . . . 0 N--CA 1.484 1.238 0 CA-C-N 119.518 1.054 . . . . 0.0 112.598 169.65 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo . . . . . 0 C--O 1.237 0.469 0 N-CA-C 114.77 1.027 . . . . 0.0 114.77 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.3 t -55.06 -50.28 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 173.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.08 -45.06 75.37 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.682 1.193 . . . . 0.0 113.208 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 12.2 mt -55.65 -63.6 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.342 1.057 . . . . 0.0 110.874 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -41.69 72.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.964 0.906 . . . . 0.0 112.842 -176.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.36 -63.64 1.1 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.093 1.757 . . . . 0.0 111.442 174.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -56.01 -48.9 75.05 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.7 mt -55.66 -35.0 65.48 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 172.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 ptt-85 33.94 59.16 1.95 Allowed Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 127.259 2.224 . . . . 0.0 115.2 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -68.01 70.78 0.84 Allowed 'Trans proline' 0 CA--C 1.548 1.203 0 C-N-CA 124.665 3.577 . . . . 0.0 114.241 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.16 30.02 74.58 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.966 1.746 . . . . 0.0 114.911 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -99.6 163.88 12.31 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 117.115 2.265 . . . . 0.0 117.115 -156.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.37 141.95 45.64 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 127.127 2.171 . . . . 0.0 112.065 161.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.428 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 29.7 m-85 -104.57 135.24 46.35 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.413 1.102 . . . . 0.0 110.874 176.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -107.46 135.73 48.44 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 128.478 2.711 . . . . 0.0 109.9 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -104.61 127.98 52.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 122.751 1.262 . . . . 0.0 110.352 174.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.9 135.83 41.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 130.014 3.326 . . . . 0.0 106.11 -171.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 t . . . . . 0 C--N 1.321 -0.662 0 N-CA-C 118.476 2.769 . . . . 0.0 118.476 -166.691 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 . . . . . 0 CA--C 1.512 -0.488 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.9 t -115.31 125.64 72.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 123.382 1.563 . . . . 0.0 108.696 -161.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.6 mmt -112.34 122.58 48.13 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.019 -1.446 . . . . 0.0 107.731 173.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -122.82 135.52 54.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.428 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -128.62 135.68 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.14 0.976 . . . . 0.0 111.365 -168.113 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.5 t -104.23 122.96 57.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 105.619 -1.993 . . . . 0.0 105.619 166.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -142.33 151.08 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.325 1.85 . . . . 0.0 108.37 -175.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.5 t70 58.01 -70.5 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.328 1.851 . . . . 0.0 114.13 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.22 18.45 0.09 OUTLIER Glycine 0 CA--C 1.543 1.817 0 C-N-CA 128.037 2.732 . . . . 0.0 112.946 167.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -135.33 169.45 17.46 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.756 2.422 . . . . 0.0 112.382 -168.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -134.21 138.83 45.38 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.466 1.106 . . . . 0.0 113.524 -166.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -135.12 158.75 43.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.874 1.67 . . . . 0.0 112.318 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -128.75 135.05 48.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.892 2.077 . . . . 0.0 109.449 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.86 122.21 3.13 Favored Glycine 0 CA--C 1.524 0.646 0 C-N-CA 125.494 1.521 . . . . 0.0 111.304 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 m -118.07 104.74 11.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 117.896 0.848 . . . . 0.0 110.903 -168.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 146.2 18.19 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.43 1.967 . . . . 0.0 114.347 -170.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -44.71 -33.06 1.71 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -155.51 179.31 9.3 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.881 1.672 . . . . 0.0 109.684 162.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.5 mtmt -43.39 -41.87 4.39 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 127.636 2.374 . . . . 0.0 115.709 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.99 -15.92 4.16 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 174.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -122.92 -42.48 2.29 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.931 2.092 . . . . 0.0 111.297 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.42 -57.89 10.02 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.227 1.411 . . . . 0.0 112.295 172.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -55.37 -44.46 76.05 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-O 117.586 -1.197 . . . . 0.0 110.863 170.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 -51.9 65.0 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 120.341 1.428 . . . . 0.0 113.463 178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.6 mmm-85 -55.36 -53.39 56.8 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.164 1.785 . . . . 0.0 113.24 170.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.79 65.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.97 0.908 . . . . 0.0 112.319 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.71 67.63 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 127.298 2.239 . . . . 0.0 112.403 171.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -55.01 -51.01 67.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.234 1.414 . . . . 0.0 111.822 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -55.26 -54.0 48.97 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.868 0.867 . . . . 0.0 112.812 171.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.23 -55.95 25.48 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.611 1.165 . . . . 0.0 113.19 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -59.8 3.5 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 127.826 2.45 . . . . 0.0 110.545 177.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.23 -49.6 69.07 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.177 0.298 . . . . 0.0 111.078 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 44.8 m -55.28 -72.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.541 1.136 . . . . 0.0 113.98 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.251 24.4 m -55.54 -46.17 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.8 m-30 -59.64 -44.69 93.41 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 174.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -55.58 -39.36 70.6 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.916 1.235 . . . . 0.0 113.887 168.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.552 1.041 0 C-N-CA 125.579 1.552 . . . . 0.0 112.215 167.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo . . . . . 0 CA--C 1.529 0.231 0 CA-C-O 118.649 -0.646 . . . . 0.0 113.627 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 60.4 t -55.07 -50.3 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.165 0.893 . . . . 0.0 109.214 173.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.28 -53.6 54.07 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.944 1.298 . . . . 0.0 114.271 -177.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 15.0 pt -58.71 -49.88 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 172.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.252 0.0 OUTLIER -55.59 -45.33 77.42 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.663 1.12 . . . . 0.0 113.838 176.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.13 -56.46 19.67 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 127.106 2.163 . . . . 0.0 111.432 174.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.61 -63.82 1.05 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.111 1.364 . . . . 0.0 114.042 173.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.7 mt -55.54 -23.73 28.2 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 35.92 51.21 1.5 Allowed Pre-proline 0 N--CA 1.48 1.07 0 C-N-CA 127.557 2.343 . . . . 0.0 114.778 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.73 46.85 1.99 Allowed 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 124.657 3.571 . . . . 0.0 116.012 -156.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.04 20.16 Favored Glycine 0 CA--C 1.534 1.251 0 O-C-N 120.521 -1.362 . . . . 0.0 113.538 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -97.58 166.27 11.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.774 1.63 . . . . 0.0 114.933 -173.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.63 150.77 49.74 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.299 1.44 . . . . 0.0 112.654 145.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.55 135.83 45.25 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.842 1.257 . . . . 0.0 112.145 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -124.66 135.72 53.31 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.695 1.598 . . . . 0.0 110.266 166.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -104.42 135.14 46.42 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 123.381 1.562 . . . . 0.0 110.678 -175.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -134.5 161.74 34.21 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 131.691 3.996 . . . . 0.0 106.1 -164.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.7 m . . . . . 0 C--N 1.319 -0.759 0 O-C-N 119.64 -1.913 . . . . 0.0 112.488 158.026 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 104.488 -2.412 . . . . 0.0 104.488 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 69.2 t -120.76 130.07 74.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.29 1.043 . . . . 0.0 110.841 -159.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 13.5 mmm -109.22 123.23 48.91 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 171.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.6 p -104.88 135.62 45.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.227 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -125.25 135.47 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.788 -0.57 . . . . 0.0 111.264 172.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.3 t -104.54 124.16 58.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 165.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.4 p -152.28 140.96 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.305 1.042 . . . . 0.0 110.174 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.5 t70 62.3 -25.16 0.05 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.937 2.095 . . . . 0.0 116.327 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 133.17 -4.76 4.95 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 126.939 2.209 . . . . 0.0 112.886 -165.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -105.02 168.02 9.33 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.223 2.209 . . . . 0.0 110.808 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -135.09 139.89 45.08 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.076 1.35 . . . . 0.0 110.643 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -135.06 150.84 50.34 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.529 1.132 . . . . 0.0 111.041 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -115.29 135.09 54.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.025 1.73 . . . . 0.0 109.351 166.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.62 114.22 2.79 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 125.11 1.338 . . . . 0.0 110.373 168.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.8 p -104.83 108.86 20.57 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 122.577 1.18 . . . . 0.0 109.601 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.44 140.8 11.97 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 126.192 1.853 . . . . 0.0 113.283 -165.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -17.07 6.16 Favored 'General case' 0 CA--C 1.557 1.237 0 O-C-N 121.291 -1.123 . . . . 0.0 113.947 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -160.42 162.24 33.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 129.429 3.092 . . . . 0.0 109.584 170.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.2 mttp -43.93 -37.73 3.04 Favored 'General case' 0 N--CA 1.5 2.063 0 CA-C-N 121.707 2.048 . . . . 0.0 115.455 172.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -14.43 7.4 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 120.159 1.345 . . . . 0.0 114.218 174.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.0 tp -122.24 -40.0 2.53 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.294 2.238 . . . . 0.0 111.897 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.25 34.33 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.405 -1.434 . . . . 0.0 111.737 173.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -55.32 -41.84 72.96 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-O 117.785 -1.102 . . . . 0.0 111.768 168.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.58 -50.78 69.17 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 120.429 1.468 . . . . 0.0 113.677 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -55.5 -54.06 48.66 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 128.563 2.745 . . . . 0.0 112.661 169.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -53.82 51.39 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.869 1.268 . . . . 0.0 111.672 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.43 -56.82 8.39 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 126.794 2.038 . . . . 0.0 112.269 169.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -52.64 -49.41 65.24 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.112 1.365 . . . . 0.0 112.525 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.22 -57.94 9.72 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.105 1.362 . . . . 0.0 112.165 173.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -56.73 16.62 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.651 1.18 . . . . 0.0 112.354 176.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.5 -63.82 0.82 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 128.208 2.603 . . . . 0.0 110.82 176.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.48 -51.65 62.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 117.82 0.282 . . . . 0.0 110.94 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.0 m -55.3 -78.25 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 15.8 m -55.25 -45.75 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.433 1.015 . . . . 0.0 113.179 -174.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -57.64 -45.42 85.49 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.755 -1.215 . . . . 0.0 112.539 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . 0.319 8.1 t-20 -57.26 -31.25 65.39 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 164.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.1 mt . . . . . 0 N--CA 1.477 0.876 0 CA-C-N 119.709 1.14 . . . . 0.0 113.647 170.001 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo . . . . . 0 CA--C 1.527 0.157 0 N-CA-C 115.366 1.256 . . . . 0.0 115.366 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.1 t -53.87 -53.65 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.26 0.936 . . . . 0.0 109.208 173.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.3 ttt -55.53 -41.05 72.64 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.352 1.861 . . . . 0.0 114.728 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.1 mt -62.2 -59.21 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.789 1.635 . . . . 0.0 112.727 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -55.48 -35.97 66.11 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.622 0.769 . . . . 0.0 112.426 177.953 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -55.54 -58.37 8.05 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.954 1.702 . . . . 0.0 112.945 162.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.45 -49.69 71.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.038 -1.664 . . . . 0.0 113.317 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.0 mt -55.91 -42.38 75.94 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 170.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 11.12 80.05 0.06 OUTLIER Pre-proline 0 N--CA 1.49 1.526 0 C-N-CA 129.158 2.983 . . . . 0.0 115.321 -175.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -68.97 -173.18 0.57 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.612 2.208 . . . . 0.0 110.516 161.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -71.36 39.9 0.59 Allowed Glycine 0 CA--C 1.541 1.682 0 C-N-CA 125.202 1.382 . . . . 0.0 115.168 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -78.6 163.31 25.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.655 1.582 . . . . 0.0 112.968 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -135.54 135.95 40.77 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.557 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -104.37 135.55 45.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.033 1.333 . . . . 0.0 111.046 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.52 135.91 50.45 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 129.415 3.086 . . . . 0.0 110.367 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -104.32 128.21 52.09 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 122.66 1.219 . . . . 0.0 109.984 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.8 mp -135.03 135.74 41.56 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 129.244 3.018 . . . . 0.0 106.599 -170.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--N 1.319 -0.748 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -160.563 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 CA--C 1.504 -0.801 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.0 t -110.14 122.45 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 CA-C-N 113.384 -1.735 . . . . 0.0 106.793 -169.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 69.0 mmm -113.62 128.79 56.56 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 172.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -131.7 135.14 46.62 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.681 0.613 . . . . 0.0 110.185 -175.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -127.48 135.75 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 121.03 -1.044 . . . . 0.0 110.37 -167.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.16 118.26 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 105.115 -2.179 . . . . 0.0 105.115 168.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -118.69 -35.95 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.349 -159.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -131.26 -13.6 3.45 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.265 . . . . 0.0 113.884 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.33 -17.19 29.07 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 123.905 0.764 . . . . 0.0 112.096 -147.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -104.69 158.92 16.17 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 125.231 1.412 . . . . 0.0 110.747 163.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -135.08 141.09 46.0 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.043 1.737 . . . . 0.0 111.581 -161.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -134.99 127.54 30.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.977 1.311 . . . . 0.0 111.62 -171.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -99.23 135.17 41.02 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.215 1.806 . . . . 0.0 109.251 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.05 115.96 1.48 Allowed Glycine 0 CA--C 1.525 0.669 0 O-C-N 121.65 -0.656 . . . . 0.0 113.381 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.7 p -104.89 104.73 14.54 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.18 1.392 . . . . 0.0 111.533 -174.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.95 147.27 19.12 Favored Glycine 0 CA--C 1.528 0.906 0 N-CA-C 116.266 1.266 . . . . 0.0 116.266 -173.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -47.91 -26.33 1.67 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -152.83 -174.26 4.86 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.824 1.25 . . . . 0.0 109.344 149.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -42.36 -38.92 1.99 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 126.522 1.929 . . . . 0.0 114.234 172.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -45.61 -30.09 1.41 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.482 1.913 . . . . 0.0 115.52 171.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.5 tp -122.28 -36.49 2.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 111.466 -175.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.72 -56.31 22.02 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.39 1.476 . . . . 0.0 112.154 170.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 ttmt -55.02 -46.08 75.22 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 117.228 -1.368 . . . . 0.0 109.425 169.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -49.19 72.85 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 120.664 1.574 . . . . 0.0 113.064 -179.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -55.35 -57.36 12.17 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.824 0.849 . . . . 0.0 113.209 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.47 66.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.308 0.643 . . . . 0.0 112.325 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.39 -53.77 49.55 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.969 2.508 . . . . 0.0 113.372 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -55.3 -51.44 66.68 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.149 1.34 . . . . 0.0 111.389 176.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.2 m -55.38 -49.34 72.57 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.598 1.159 . . . . 0.0 112.115 177.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -65.7 0.54 Allowed 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.393 1.477 . . . . 0.0 111.477 170.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -37.47 -57.71 0.91 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.704 2.002 . . . . 0.0 111.988 177.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.12 -62.55 1.59 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 m -55.45 -54.17 47.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 49.8 t -55.02 -62.98 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 127.391 2.276 . . . . 0.0 109.733 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -57.29 -42.14 81.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.78 -38.66 70.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.839 0.856 . . . . 0.0 112.448 170.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.548 0.896 0 C-N-CA 124.124 0.969 . . . . 0.0 109.9 165.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo . . . . . 0 C--O 1.235 0.364 0 N-CA-C 114.01 0.734 . . . . 0.0 114.01 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.3 t -53.82 -54.96 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 122.351 1.072 . . . . 0.0 108.124 171.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 tpt -55.62 -50.38 70.31 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 126.274 1.83 . . . . 0.0 115.816 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 9.6 pt -57.72 -51.15 73.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 120.768 1.622 . . . . 0.0 113.576 167.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.302 0.0 OUTLIER -55.57 -45.02 77.37 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.02 1.282 . . . . 0.0 114.094 179.459 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -55.32 -53.95 49.73 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.998 2.519 . . . . 0.0 112.685 170.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -55.51 -57.06 13.48 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.478 1.111 . . . . 0.0 113.153 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.39 -44.77 76.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.92 1.688 . . . . 0.0 114.769 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 35.43 65.81 1.76 Allowed Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.245 1.818 . . . . 0.0 114.93 -168.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.53 78.53 0.18 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.317 2.678 . . . . 0.0 113.196 168.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.61 27.54 66.34 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 126.362 1.934 . . . . 0.0 115.992 171.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 pp -106.35 158.16 17.08 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 117.318 2.34 . . . . 0.0 117.318 -155.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 135.87 40.02 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 127.691 2.396 . . . . 0.0 113.608 168.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -104.59 135.4 46.06 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.293 1.037 . . . . 0.0 111.437 176.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -104.89 135.65 45.84 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.354 1.862 . . . . 0.0 109.186 164.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -104.64 130.8 52.61 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 122.764 1.268 . . . . 0.0 110.513 170.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.54 151.28 49.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 129.741 3.216 . . . . 0.0 106.025 -172.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.4 m . . . . . 0 C--N 1.318 -0.779 0 O-C-N 120.843 -1.16 . . . . 0.0 109.025 149.671 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.65 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 25.6 t -108.57 131.63 58.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.909 -160.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.7 mmt -104.7 124.23 49.01 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 169.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.16 134.79 55.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.4 135.81 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.503 -169.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.1 t -104.22 120.6 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.3 t -142.99 134.05 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.91 1.684 . . . . 0.0 108.863 -162.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 t70 56.66 -66.93 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 127.751 2.42 . . . . 0.0 113.854 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.68 19.26 0.06 OUTLIER Glycine 0 CA--C 1.54 1.618 0 C-N-CA 128.576 2.989 . . . . 0.0 111.942 174.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -126.62 176.33 7.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.959 2.504 . . . . 0.0 109.252 -170.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -130.67 134.67 47.13 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.996 0.919 . . . . 0.0 111.901 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -135.0 150.24 50.31 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.416 1.486 . . . . 0.0 111.177 -173.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.23 135.1 30.36 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.474 1.11 . . . . 0.0 111.019 -173.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.79 120.73 2.73 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.731 1.634 . . . . 0.0 111.048 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 p -104.96 104.69 14.48 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.421 1.088 . . . . 0.0 110.47 -176.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.56 135.72 8.03 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 115.044 0.778 . . . . 0.0 115.044 -166.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -62.27 -1.98 0.88 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 170.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -161.2 158.56 27.58 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.561 2.344 . . . . 0.0 108.963 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -55.56 -32.73 63.26 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 121.028 1.74 . . . . 0.0 114.943 170.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -5.32 5.19 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 121.629 2.013 . . . . 0.0 115.247 169.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.7 tp -117.85 -52.44 2.43 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.412 1.885 . . . . 0.0 110.53 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.3 -53.89 50.38 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.372 1.469 . . . . 0.0 112.501 173.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -55.5 -47.79 75.65 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 117.462 -1.256 . . . . 0.0 112.294 168.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -48.51 74.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 120.474 1.488 . . . . 0.0 112.529 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.6 mmm-85 -54.96 -59.47 4.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 129.228 3.011 . . . . 0.0 113.291 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -50.2 70.41 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.924 0.89 . . . . 0.0 112.457 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.93 -52.3 63.39 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 126.245 1.818 . . . . 0.0 112.8 172.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -52.65 -50.47 63.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.941 1.696 . . . . 0.0 111.843 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.2 m -55.33 -55.08 35.66 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.646 1.178 . . . . 0.0 112.193 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.05 -61.12 2.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 112.224 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -44.64 -60.12 2.15 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.791 2.436 . . . . 0.0 111.49 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.29 -53.25 56.35 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 117.886 0.312 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.8 m -55.25 -73.83 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.264 4.9 m -55.66 -47.11 79.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 124.8 1.24 . . . . 0.0 114.081 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -57.15 -47.23 81.69 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -55.45 -38.37 68.94 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.665 1.12 . . . . 0.0 112.946 172.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.547 0.839 0 C-N-CA 125.001 1.32 . . . . 0.0 110.36 167.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo . . . . . 0 C--O 1.238 0.509 0 N-CA-C 114.355 0.867 . . . . 0.0 114.355 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 13.3 t -55.1 -48.76 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -43.35 75.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.04 1.336 . . . . 0.0 114.525 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.5 mt -55.89 -61.06 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.744 1.218 . . . . 0.0 111.517 168.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.258 0.0 OUTLIER -55.27 -37.85 67.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.787 0.803 . . . . 0.0 112.806 -179.194 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -55.4 -56.98 13.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.954 2.102 . . . . 0.0 113.263 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -55.3 -53.33 57.53 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.95 2.1 . . . . 0.0 112.508 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -40.95 72.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.588 2.755 . . . . 0.0 115.078 173.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.331 0.0 OUTLIER 5.42 80.81 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 129.337 3.055 . . . . 0.0 118.055 -168.371 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.05 -175.83 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 124.311 3.341 . . . . 0.0 114.995 163.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.03 83.03 0.07 OUTLIER Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.121 -0.987 . . . . 0.0 111.507 162.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.32 160.7 33.14 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -175.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -135.7 135.78 40.34 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.826 2.05 . . . . 0.0 113.438 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -104.53 135.55 45.73 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.805 1.242 . . . . 0.0 110.668 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -125.99 135.73 52.16 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.91 2.084 . . . . 0.0 109.985 -178.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -104.63 131.47 52.02 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.509 1.147 . . . . 0.0 111.332 -172.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -134.94 135.63 41.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 128.848 2.859 . . . . 0.0 107.342 -175.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 p . . . . . 0 C--N 1.319 -0.741 0 O-C-N 119.86 -1.775 . . . . 0.0 112.663 159.744 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 . . . . . 0 C--O 1.232 0.143 0 N-CA-C 105.315 -2.106 . . . . 0.0 105.315 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -122.57 115.79 47.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.14 -157.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 82.1 mmm -104.9 117.34 33.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.834 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p -104.88 135.52 46.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.778 177.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.12 135.55 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.673 -0.642 . . . . 0.0 110.207 -172.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.2 t -104.27 116.46 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 169.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 63.1 t -137.67 123.33 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.487 1.515 . . . . 0.0 108.46 -165.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.8 t70 63.88 -29.44 0.1 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 127.244 2.218 . . . . 0.0 116.2 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 139.93 -5.81 2.82 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.555 1.55 . . . . 0.0 113.056 -161.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -104.95 167.92 9.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.101 2.161 . . . . 0.0 110.117 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -134.55 139.11 45.15 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.754 0.822 . . . . 0.0 112.227 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -135.04 158.99 42.93 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.435 1.494 . . . . 0.0 112.161 -176.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -135.45 121.67 20.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.23 1.812 . . . . 0.0 108.983 171.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -114.79 105.25 1.48 Allowed Glycine 0 CA--C 1.52 0.364 0 C-N-CA 126.013 1.768 . . . . 0.0 109.644 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -105.28 104.36 14.08 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.76 0.791 . . . . 0.0 110.126 -170.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.11 136.37 8.38 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.966 1.746 . . . . 0.0 114.36 -169.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -48.35 -26.72 2.17 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.519 ' HB3' ' HE2' ' A' ' 52' ' ' LYS . 20.3 t-20 -150.36 166.29 30.49 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 125.775 1.63 . . . . 0.0 111.072 169.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -46.61 -46.84 19.94 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.355 1.434 . . . . 0.0 114.407 -175.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.519 ' HE2' ' HB3' ' A' ' 50' ' ' ASN . 0.0 OUTLIER -58.47 -5.81 0.59 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 116.096 1.887 . . . . 0.0 116.096 175.986 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.6 tp -120.11 -42.89 2.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.296 2.238 . . . . 0.0 110.869 173.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.43 -59.57 4.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.089 1.356 . . . . 0.0 112.507 171.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -55.46 -39.83 70.85 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-O 115.455 -2.212 . . . . 0.0 112.984 164.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.28 -52.1 64.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 123.37 2.805 . . . . 0.0 111.907 178.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.23 -54.29 45.28 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.503 1.921 . . . . 0.0 114.078 169.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -58.37 8.05 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.29 -51.93 13.63 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 125.034 1.334 . . . . 0.0 114.105 167.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -55.13 -51.37 66.64 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.226 1.41 . . . . 0.0 112.052 178.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.2 m -55.28 -53.06 60.82 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.705 1.202 . . . . 0.0 111.831 174.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -61.7 2.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.229 175.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.59 -60.11 2.14 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 127.3 2.24 . . . . 0.0 110.97 178.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.05 -52.4 63.31 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.212 0.205 . . . . 0.0 111.495 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 m -55.36 -69.02 0.15 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.297 32.8 m -55.39 -47.13 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -176.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -56.73 -38.53 72.5 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -55.93 -44.97 78.84 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.126 1.33 . . . . 0.0 111.659 171.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.257 3.5 pp . . . . . 0 CA--C 1.541 0.627 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 175.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo . . . . . 0 C--O 1.236 0.391 0 N-CA-C 114.752 1.02 . . . . 0.0 114.752 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 74.8 t -55.1 -48.06 76.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.464 0 CA-C-N 118.264 0.484 . . . . 0.0 109.729 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.47 -42.53 74.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.913 1.285 . . . . 0.0 114.112 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.5 mt -55.98 -59.26 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.299 1.04 . . . . 0.0 113.091 167.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.498 ' CD1' ' HH ' ' A' ' 19' ' ' TYR 0.27 0.0 OUTLIER -55.4 -37.5 67.67 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.348 0.659 . . . . 0.0 112.062 -179.308 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -55.35 -61.81 2.09 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.461 2.304 . . . . 0.0 112.67 164.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.52 -53.4 56.8 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.187 -0.945 . . . . 0.0 112.343 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.8 mt -56.92 -40.22 75.92 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 171.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.42 0.0 OUTLIER 0.91 73.52 0.04 OUTLIER Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 127.831 2.452 . . . . 0.0 117.032 -160.619 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.08 64.06 5.15 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 124.346 3.364 . . . . 0.0 113.864 -173.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.08 27.34 73.72 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.739 1.161 . . . . 0.0 114.843 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -91.66 167.82 11.93 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.749 1.619 . . . . 0.0 113.676 -171.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -135.22 136.47 41.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.456 1.502 . . . . 0.0 113.367 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.498 ' HH ' ' CD1' ' A' ' 10' ' ' LEU . 32.2 m-85 -104.32 135.4 45.85 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.045 0.938 . . . . 0.0 110.827 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -123.81 120.6 33.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.679 1.992 . . . . 0.0 109.158 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -104.95 131.56 52.3 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.551 1.14 . . . . 0.0 111.787 -167.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.38 168.48 18.51 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 126.669 1.988 . . . . 0.0 106.629 -179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.1 p . . . . . 0 C--N 1.311 -1.066 0 O-C-N 119.594 -1.941 . . . . 0.0 111.426 -179.607 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 N--CA 1.462 0.147 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.49 129.29 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-O 122.931 1.348 . . . . 0.0 114.507 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.29 125.38 53.82 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 120.678 -1.264 . . . . 0.0 110.154 -176.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.5 p -114.5 142.74 46.01 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 124.351 1.061 . . . . 0.0 111.708 177.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.18 135.94 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 120.891 -1.131 . . . . 0.0 110.973 -175.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.18 118.28 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 170.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -132.92 -33.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -158.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -137.59 13.35 2.97 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 122.221 1.01 . . . . 0.0 113.484 -160.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.29 -11.25 31.44 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -153.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -105.15 164.29 11.93 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 128.219 2.608 . . . . 0.0 110.862 175.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -129.83 138.68 51.13 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.301 1.84 . . . . 0.0 109.811 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -132.51 152.94 51.39 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.658 1.583 . . . . 0.0 109.194 -174.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -140.68 135.27 31.47 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.236 1.014 . . . . 0.0 111.178 173.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.66 122.79 4.67 Favored Glycine 0 CA--C 1.523 0.566 0 C-N-CA 126.519 2.009 . . . . 0.0 111.284 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 t -104.91 119.69 39.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.78 0.832 . . . . 0.0 110.549 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.28 149.14 20.82 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 125.104 1.335 . . . . 0.0 116.06 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -48.98 -26.16 2.37 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 175.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -161.15 -176.27 5.35 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.11 1.764 . . . . 0.0 108.78 152.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.5 mtmm -45.76 -38.66 7.27 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.943 2.097 . . . . 0.0 115.33 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -16.13 4.38 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 173.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.4 tp -123.38 -40.41 2.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.149 2.18 . . . . 0.0 111.786 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.69 -57.64 11.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.103 1.361 . . . . 0.0 112.291 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.6 ttmt -55.14 -45.82 75.65 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-O 116.61 -1.662 . . . . 0.0 109.376 169.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.44 75.44 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 121.994 2.179 . . . . 0.0 113.441 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -55.51 -57.82 10.31 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.815 0.846 . . . . 0.0 112.858 170.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.36 -52.27 64.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.082 0.953 . . . . 0.0 112.164 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.06 -58.37 6.76 Favored 'General case' 0 C--O 1.215 -0.723 0 C-N-CA 128.247 2.619 . . . . 0.0 111.978 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.04 -47.43 74.79 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 120.133 1.333 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 m -55.29 -55.63 29.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.22 1.008 . . . . 0.0 112.141 175.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -53.28 58.02 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.809 1.244 . . . . 0.0 112.839 173.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.87 -61.66 1.85 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 128.055 2.542 . . . . 0.0 110.325 176.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.31 -46.29 72.79 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 122.93 0.492 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.4 m -55.14 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.552 0.741 . . . . 0.0 112.767 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.0 m -55.45 -40.0 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -176.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -59.84 -43.76 94.44 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 113.959 172.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -35.37 65.92 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.258 1.39 . . . . 0.0 113.811 163.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 N--CA 1.481 1.099 0 CA-C-N 119.324 0.966 . . . . 0.0 113.334 170.668 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 N--CA 1.461 -0.415 0 N-CA-C 113.901 0.693 . . . . 0.0 113.901 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 93.5 t -52.76 -55.01 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 122.664 1.221 . . . . 0.0 108.88 173.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.2 tpt -55.79 -51.49 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 10.4 pt -55.67 -47.71 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 166.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.429 ' CD1' ' HH ' ' A' ' 19' ' ' TYR 0.283 0.0 OUTLIER -55.63 -43.1 75.85 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.996 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.08 -54.59 41.2 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 112.031 172.027 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.53 -64.14 0.94 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.428 1.891 . . . . 0.0 112.739 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.281 50.6 mt -56.08 -25.21 44.45 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 116.369 1.989 . . . . 0.0 116.369 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER 22.64 61.38 0.33 Allowed Pre-proline 0 N--CA 1.491 1.583 0 C-N-CA 129.038 2.935 . . . . 0.0 116.495 -178.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.44 39.59 0.42 Allowed 'Trans proline' 0 CA--C 1.555 1.56 1 C-N-CA 125.416 4.078 . . . . 0.0 117.169 -160.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.66 32.22 13.79 Favored Glycine 0 CA--C 1.534 1.256 0 O-C-N 120.266 -1.521 . . . . 0.0 113.737 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.31 171.58 7.29 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -169.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -135.33 140.25 44.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.621 2.369 . . . . 0.0 111.513 160.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.429 ' HH ' ' CD1' ' A' ' 10' ' ' LEU . 27.2 m-85 -104.42 135.43 45.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.415 1.086 . . . . 0.0 110.841 176.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -128.9 127.67 42.26 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.565 1.546 . . . . 0.0 109.409 176.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -105.35 131.24 53.04 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.506 1.122 . . . . 0.0 111.707 -170.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.23 170.16 15.84 Favored 'General case' 0 N--CA 1.44 -0.953 0 C-N-CA 127.917 2.487 . . . . 0.0 105.584 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--N 1.315 -0.934 0 O-C-N 119.533 -1.979 . . . . 0.0 110.56 174.717 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 . . . . . 0 N--CA 1.461 0.083 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.65 135.12 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-O 123.775 1.75 . . . . 0.0 114.77 -169.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.89 130.36 56.8 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.267 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 p -119.31 135.64 54.62 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.06 0.944 . . . . 0.0 111.437 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.4 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 2.3 m -122.15 135.69 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.01 0.924 . . . . 0.0 111.534 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.7 t -104.39 127.1 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 165.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.8 p -148.32 148.68 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.429 1.491 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 t70 60.19 -66.4 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 127.452 2.301 . . . . 0.0 114.258 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -173.01 19.14 0.06 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 128.245 2.831 . . . . 0.0 112.396 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -135.27 167.37 21.14 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.576 2.35 . . . . 0.0 111.66 -168.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -134.95 136.73 42.47 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.627 1.171 . . . . 0.0 112.391 -165.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -135.09 153.92 51.86 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.898 1.679 . . . . 0.0 110.936 -175.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -137.95 135.17 35.77 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.857 1.263 . . . . 0.0 111.889 -178.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.69 106.6 0.63 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 127.368 2.413 . . . . 0.0 111.464 -172.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 p -104.74 114.55 28.83 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.695 1.247 . . . . 0.0 110.72 -177.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.97 143.23 14.65 Favored Glycine 0 CA--C 1.528 0.881 0 CA-C-N 114.412 -1.267 . . . . 0.0 115.562 -170.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -30.05 -53.47 0.16 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 125.573 1.549 . . . . 0.0 114.546 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -137.94 -175.59 4.14 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.81 1.244 . . . . 0.0 110.593 159.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -45.28 -43.66 10.73 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.185 1.394 . . . . 0.0 114.479 177.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.04 -17.17 2.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 115.835 1.791 . . . . 0.0 115.835 177.244 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.4 tp -115.41 -38.48 3.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.196 1.798 . . . . 0.0 111.254 174.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.47 -54.62 41.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.514 1.126 . . . . 0.0 112.079 173.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.3 mmtt -55.19 -44.05 74.96 Favored 'General case' 0 C--O 1.204 -1.32 0 CA-C-O 114.91 -2.472 . . . . 0.0 112.457 162.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -47.69 75.28 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 124.324 3.238 . . . . 0.0 111.474 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -55.39 -62.85 1.4 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.452 1.901 . . . . 0.0 112.728 171.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.1 -55.72 27.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.262 1.425 . . . . 0.0 112.559 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -42.37 -63.92 0.68 Allowed 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 125.592 1.557 . . . . 0.0 114.21 165.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -45.32 75.76 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.832 1.651 . . . . 0.0 111.606 -176.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 m -55.23 -57.73 10.58 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.307 0.643 . . . . 0.0 112.296 175.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -50.87 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.287 1.035 . . . . 0.0 112.503 175.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -60.56 3.12 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.51 1.924 . . . . 0.0 111.164 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.39 -47.59 69.39 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.076 0.398 . . . . 0.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 37.6 m -55.35 -71.19 0.09 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 173.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.9 m -55.22 -39.93 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.281 0.946 . . . . 0.0 113.43 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -56.32 -46.01 80.07 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.845 -1.159 . . . . 0.0 113.993 170.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -34.97 65.59 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 165.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 20.1 mt . . . . . 0 N--CA 1.483 1.191 0 CA-C-N 119.296 0.953 . . . . 0.0 112.73 170.552 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo . . . . . 0 C--O 1.238 0.478 0 N-CA-C 115.161 1.177 . . . . 0.0 115.161 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.5 t -52.08 -49.69 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.085 0.554 . . . . 0.0 109.616 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -55.56 -51.81 65.85 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.0 mt -55.75 -51.19 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.643 1.11 . . . . 0.0 111.884 174.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.86 -51.44 63.61 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.561 1.144 . . . . 0.0 109.876 176.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -55.73 -52.37 64.16 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.127 1.771 . . . . 0.0 112.444 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -55.35 -60.08 3.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.044 2.138 . . . . 0.0 113.58 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.4 mt -55.89 -39.33 71.42 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 30.97 65.6 0.93 Allowed Pre-proline 0 N--CA 1.487 1.404 0 C-N-CA 128.048 2.539 . . . . 0.0 115.495 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -64.59 -34.05 53.59 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.144 2.563 . . . . 0.0 114.435 -167.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.99 25.05 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.693 1.616 . . . . 0.0 113.335 177.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.3 mt -58.92 136.27 57.82 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 126.58 1.952 . . . . 0.0 114.866 -165.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -135.08 135.93 41.63 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.629 1.572 . . . . 0.0 110.363 147.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.405 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 20.1 m-85 -104.67 135.28 46.36 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.664 1.228 . . . . 0.0 110.735 -178.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.68 135.59 55.08 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 128.017 2.527 . . . . 0.0 109.101 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -104.79 126.05 51.47 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 122.831 1.3 . . . . 0.0 111.618 -175.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.64 145.84 51.4 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 130.928 3.691 . . . . 0.0 105.631 -176.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.475 0.818 0 O-C-N 119.399 -2.063 . . . . 0.0 110.344 -172.448 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 21.4 m-30 . . . . . 0 N--CA 1.447 -0.602 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -108.58 116.38 51.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 113.493 -1.685 . . . . 0.0 107.406 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 11.8 mmt -104.71 123.8 48.25 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 m -123.13 135.06 54.19 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.405 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 1.8 m -127.91 135.43 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.054 0.942 . . . . 0.0 111.989 -169.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.7 t -104.36 125.26 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 167.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 94.3 t -135.36 -33.86 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -158.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -149.21 26.48 0.87 Allowed 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 122.408 1.099 . . . . 0.0 111.566 -160.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.23 -15.44 8.9 Favored Glycine 0 CA--C 1.538 1.474 0 O-C-N 120.797 -1.189 . . . . 0.0 112.873 -161.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -112.1 168.76 9.35 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.769 2.027 . . . . 0.0 112.252 175.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -133.48 140.23 47.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.585 1.954 . . . . 0.0 111.106 -163.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.97 155.25 51.07 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.945 1.698 . . . . 0.0 110.762 -175.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -132.74 135.08 45.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.285 1.034 . . . . 0.0 110.581 -176.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.01 109.24 0.85 Allowed Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.106 1.336 . . . . 0.0 112.522 -166.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.7 p -104.78 104.63 14.45 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.019 0.909 . . . . 0.0 112.245 -168.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.17 135.93 7.62 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 116.139 1.215 . . . . 0.0 116.139 -176.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -50.46 -23.8 2.69 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -149.34 176.94 10.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.268 1.027 . . . . 0.0 110.831 157.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -47.11 -48.35 22.99 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 125.897 1.679 . . . . 0.0 114.444 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.23 -9.41 0.65 Allowed 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 176.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.8 tp -117.56 -41.73 2.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.808 2.043 . . . . 0.0 110.798 172.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.63 -59.52 4.73 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.647 1.579 . . . . 0.0 113.036 173.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -55.46 -41.58 73.12 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 115.667 -2.111 . . . . 0.0 112.532 164.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -48.97 73.22 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 122.719 2.508 . . . . 0.0 111.19 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -55.32 -58.82 6.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.728 2.011 . . . . 0.0 115.343 163.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.38 -53.71 52.86 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.766 1.166 . . . . 0.0 111.889 -176.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -40.58 -72.84 0.06 Allowed 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 117.525 -1.226 . . . . 0.0 113.634 156.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -45.27 -46.32 12.56 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.175 1.807 . . . . 0.0 113.796 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.4 m -55.27 -63.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.881 1.272 . . . . 0.0 112.895 170.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.34 -59.58 4.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.078 0.951 . . . . 0.0 112.81 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -45.27 -63.34 0.96 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.779 3.231 . . . . 0.0 111.226 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.21 -45.02 75.9 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 175.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 85.5 m -55.33 -68.46 0.19 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.583 0.629 . . . . 0.0 112.359 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.4 m -55.29 -35.32 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.409 1.004 . . . . 0.0 113.125 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -63.73 -40.56 97.03 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.616 -1.303 . . . . 0.0 114.115 175.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -55.41 -39.32 70.07 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 118.926 0.785 . . . . 0.0 112.503 162.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 N--CA 1.483 1.213 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 170.198 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo . . . . . 0 CA--C 1.534 0.523 0 N-CA-C 114.962 1.101 . . . . 0.0 114.962 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 15.2 t -55.44 -52.98 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.666 1.121 . . . . 0.0 109.287 160.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.49 -48.93 73.81 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -176.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.4 pt -60.13 -49.68 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.586 1.085 . . . . 0.0 111.805 169.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.348 0.0 OUTLIER -55.94 -39.37 71.6 Favored 'General case' 0 N--CA 1.461 0.094 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 177.666 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -55.54 -60.2 3.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.619 1.968 . . . . 0.0 109.426 169.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -55.2 -59.2 5.11 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.438 1.495 . . . . 0.0 113.999 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.6 mt -55.73 -45.27 78.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.157 1.783 . . . . 0.0 115.619 171.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 34.83 65.85 1.58 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 127.051 2.14 . . . . 0.0 115.3 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.64 33.91 0.09 OUTLIER 'Trans proline' 0 CA--C 1.557 1.659 1 C-N-CA 125.814 4.342 . . . . 0.0 118.452 -175.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 10.93 85.36 Favored Glycine 0 CA--C 1.539 1.587 0 O-C-N 119.762 -1.836 . . . . 0.0 114.351 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.22 164.0 4.53 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.304 2.241 . . . . 0.0 115.337 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.07 139.49 44.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.79 2.036 . . . . 0.0 111.818 164.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -104.56 135.37 46.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.276 1.03 . . . . 0.0 112.376 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -118.71 135.17 54.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.498 2.319 . . . . 0.0 109.241 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -112.37 129.23 56.38 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 122.315 1.055 . . . . 0.0 112.146 -174.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.74 150.99 51.49 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 129.75 3.22 . . . . 0.0 108.392 -171.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 C--N 1.316 -0.862 0 C-N-CA 126.777 2.031 . . . . 0.0 113.977 -169.746 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.237 0.397 0 N-CA-C 102.654 -3.091 . . . . 0.0 102.654 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.1 t -124.1 130.03 73.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 123.197 1.475 . . . . 0.0 109.302 -157.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.5 mmm -118.29 135.34 54.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 113.52 -1.673 . . . . 0.0 108.799 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.5 m -125.19 135.46 52.62 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.508 0.723 . . . . 0.0 110.197 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.6 m -117.86 135.92 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.251 1.021 . . . . 0.0 111.992 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.5 t -104.2 126.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 164.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.7 p -151.66 149.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.693 1.197 . . . . 0.0 110.347 -178.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 55.8 -69.85 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.32 2.248 . . . . 0.0 114.112 -168.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.02 21.88 0.08 OUTLIER Glycine 0 CA--C 1.537 1.451 0 C-N-CA 128.396 2.903 . . . . 0.0 111.794 173.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -128.55 162.43 27.27 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.441 2.296 . . . . 0.0 109.878 -167.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -132.81 133.66 43.66 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.95 1.3 . . . . 0.0 111.626 -173.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -135.11 141.5 46.03 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.608 1.163 . . . . 0.0 110.741 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -118.16 135.04 54.48 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.337 1.855 . . . . 0.0 109.976 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.82 132.7 6.55 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.625 1.107 . . . . 0.0 112.556 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -128.03 104.65 7.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.748 0.785 . . . . 0.0 111.719 -164.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.96 140.56 11.68 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 125.49 1.519 . . . . 0.0 115.161 -163.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -47.37 -27.68 1.74 Allowed 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 116.074 1.879 . . . . 0.0 116.074 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -154.97 174.75 14.72 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 126.639 1.976 . . . . 0.0 109.498 162.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -53.11 -31.78 43.89 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 127.393 2.277 . . . . 0.0 115.982 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -13.9 7.78 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 121.226 1.83 . . . . 0.0 115.127 167.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.35 -50.79 2.72 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.209 2.204 . . . . 0.0 110.264 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -52.56 63.19 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.377 -1.452 . . . . 0.0 112.962 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -55.14 -48.41 73.73 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-O 117.23 -1.367 . . . . 0.0 109.444 169.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.06 72.37 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 120.561 1.528 . . . . 0.0 113.675 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -55.31 -60.95 2.69 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.574 1.149 . . . . 0.0 112.178 172.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -50.87 68.51 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.252 1.021 . . . . 0.0 112.207 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.67 -66.98 0.29 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 126.517 1.927 . . . . 0.0 111.904 171.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -55.45 -38.49 69.12 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.257 0.935 . . . . 0.0 112.942 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 t -55.33 -59.72 4.41 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.872 0.869 . . . . 0.0 113.167 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.14 -56.39 20.43 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.122 1.369 . . . . 0.0 112.672 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -43.54 -61.49 1.37 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 111.458 172.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.24 -49.25 67.22 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.809 0.731 . . . . 0.0 111.165 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 35.9 m -55.29 -73.38 0.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 173.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.273 34.0 m -55.51 -44.39 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -56.38 -48.88 75.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 171.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.86 -37.06 68.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 120.212 1.369 . . . . 0.0 113.696 169.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.551 1.015 0 C-N-CA 124.582 1.153 . . . . 0.0 111.655 168.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 C--O 1.236 0.391 0 CA-C-O 118.681 -0.633 . . . . 0.0 113.54 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.5 t -53.87 -51.76 41.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.03 -49.13 72.33 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -177.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.64 -58.18 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.218 1.007 . . . . 0.0 111.371 174.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.06 -46.36 75.37 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.453 1.101 . . . . 0.0 111.635 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -55.56 -57.29 12.54 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.271 1.828 . . . . 0.0 112.427 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -55.85 -53.16 60.08 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.708 1.603 . . . . 0.0 113.174 175.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.46 -34.97 64.98 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.069 1.348 . . . . 0.0 113.488 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 35.8 54.11 2.22 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 127.161 2.184 . . . . 0.0 115.245 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -73.21 58.53 3.6 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 124.71 3.607 . . . . 0.0 115.227 -167.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.42 17.89 78.0 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.513 1.53 . . . . 0.0 114.84 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -81.62 174.1 11.72 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -172.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -134.97 143.06 46.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 127.127 2.171 . . . . 0.0 110.309 157.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -104.32 129.64 52.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 124.664 1.228 . . . . 0.0 109.584 172.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.72 135.18 51.71 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 127.69 2.396 . . . . 0.0 108.482 177.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -109.77 125.63 52.9 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 123.144 1.45 . . . . 0.0 111.701 -176.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 mp -135.09 157.09 47.82 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 131.319 3.847 . . . . 0.0 105.826 -173.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 C--N 1.322 -0.611 0 O-C-N 119.317 -2.114 . . . . 0.0 110.144 169.648 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 . . . . . 0 N--CA 1.445 -0.684 0 N-CA-C 104.604 -2.369 . . . . 0.0 104.604 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -118.65 117.74 55.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 123.046 1.403 . . . . 0.0 110.561 -168.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.2 mmm -105.33 126.06 51.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.733 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.7 m -116.71 135.5 53.72 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 123.652 0.781 . . . . 0.0 110.125 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 m -119.48 135.91 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.954 0.902 . . . . 0.0 111.702 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 87.8 t -104.11 127.79 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 160.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.1 p -148.85 146.93 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.825 1.65 . . . . 0.0 109.321 -174.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.6 t70 59.07 -67.22 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.944 2.098 . . . . 0.0 114.668 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 19.47 0.07 OUTLIER Glycine 0 CA--C 1.541 1.719 0 C-N-CA 128.528 2.966 . . . . 0.0 112.798 169.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -135.12 165.04 26.3 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.721 2.408 . . . . 0.0 111.667 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -133.92 137.39 44.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.538 1.135 . . . . 0.0 112.779 -167.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -135.13 157.48 46.82 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.428 1.491 . . . . 0.0 111.812 -175.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -132.83 133.83 43.87 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.557 1.943 . . . . 0.0 109.268 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -131.4 113.54 1.38 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 125.036 1.303 . . . . 0.0 112.089 -175.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.5 p -104.99 108.96 20.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.289 1.035 . . . . 0.0 112.122 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.65 143.49 15.05 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.927 1.727 . . . . 0.0 114.466 -173.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -17.85 1.47 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 177.199 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -161.5 179.51 8.17 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.499 1.92 . . . . 0.0 110.308 153.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -45.45 -40.45 8.3 Favored 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.357 1.863 . . . . 0.0 115.766 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.01 -16.96 5.62 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 174.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -118.33 -44.24 2.68 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.886 2.074 . . . . 0.0 111.378 176.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.46 -53.26 58.53 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.582 -1.324 . . . . 0.0 112.77 175.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.2 ttmt -55.24 -46.25 76.04 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-O 116.53 -1.7 . . . . 0.0 110.967 166.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.05 75.06 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 121.972 2.169 . . . . 0.0 112.578 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -55.48 -60.25 3.69 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.522 1.929 . . . . 0.0 112.163 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.24 -50.66 68.89 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.428 1.091 . . . . 0.0 112.322 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.5 -59.64 3.57 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.239 1.816 . . . . 0.0 111.618 170.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -48.35 72.77 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 120.104 1.32 . . . . 0.0 110.691 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -55.36 -60.33 3.55 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 173.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.37 -61.55 2.26 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 126.493 1.917 . . . . 0.0 112.307 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.7 tp -53.29 -53.26 53.46 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.647 2.379 . . . . 0.0 111.922 -177.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.33 74.42 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.052 0.842 . . . . 0.0 112.802 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 95.6 m -55.28 -62.55 1.6 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.6 0.76 . . . . 0.0 112.984 175.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 m -55.58 -46.29 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.95 -47.45 77.58 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.83 -38.93 70.69 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.719 1.208 . . . . 0.0 114.248 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.551 0.995 0 C-N-CA 124.993 1.317 . . . . 0.0 111.803 167.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo . . . . . 0 CA--C 1.532 0.415 0 N-CA-C 115.12 1.161 . . . . 0.0 115.12 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.6 t -55.18 -44.77 76.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 CA-C-N 118.85 0.75 . . . . 0.0 110.548 168.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.32 -42.64 74.02 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.854 -1.154 . . . . 0.0 113.019 177.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.6 mt -60.22 -57.39 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.648 1.179 . . . . 0.0 110.684 173.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.479 HD12 ' HH ' ' A' ' 19' ' ' TYR 0.315 0.0 OUTLIER -55.84 -38.9 70.68 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 115.645 1.721 . . . . 0.0 115.645 176.291 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -56.13 -52.86 62.83 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 124.848 1.259 . . . . 0.0 111.559 171.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.26 -65.62 0.55 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.705 1.602 . . . . 0.0 113.175 173.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.8 mt -55.57 -43.41 75.88 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.636 1.574 . . . . 0.0 115.234 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.263 7.7 ptm85 30.24 66.89 0.79 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 128.299 2.64 . . . . 0.0 115.246 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -61.02 20.17 0.04 OUTLIER 'Trans proline' 0 CA--C 1.552 1.392 1 C-N-CA 125.777 4.318 . . . . 0.0 118.348 -175.284 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.19 30.36 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.123 1.345 . . . . 0.0 113.698 -175.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 pp -88.7 159.67 17.71 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -176.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.46 138.42 43.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.212 1.805 . . . . 0.0 112.493 -179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.479 ' HH ' HD12 ' A' ' 10' ' ' LEU . 13.5 m-85 -104.67 135.13 46.64 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.431 1.11 . . . . 0.0 112.85 -171.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -105.28 135.32 46.86 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.018 2.527 . . . . 0.0 108.843 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -108.35 121.11 44.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.114 0.959 . . . . 0.0 110.958 175.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.6 155.97 43.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 129.453 3.101 . . . . 0.0 107.123 -175.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.7 t . . . . . 0 C--N 1.321 -0.67 0 O-C-N 120.451 -1.405 . . . . 0.0 110.857 160.121 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 . . . . . 0 CA--C 1.519 -0.244 0 N-CA-C 105.915 -1.884 . . . . 0.0 105.915 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.3 t -112.84 117.5 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 122.038 0.923 . . . . 0.0 109.208 -169.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 78.9 mmm -104.77 135.04 46.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 173.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.2 m -132.81 135.47 45.69 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 122.47 0.308 . . . . 0.0 111.055 -176.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.11 135.51 60.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.303 1.041 . . . . 0.0 112.191 -173.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.6 t -104.47 120.11 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 167.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 78.2 t -125.04 -45.44 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -157.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -148.27 29.98 0.86 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 122.669 1.223 . . . . 0.0 111.066 -162.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.94 -12.71 22.47 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 120.532 -1.355 . . . . 0.0 112.963 -162.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -109.96 161.78 15.16 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 126.688 1.995 . . . . 0.0 111.735 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -134.85 137.96 43.75 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.039 1.736 . . . . 0.0 111.389 -162.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -134.97 149.94 50.29 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.373 1.469 . . . . 0.0 111.088 -175.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -132.9 135.04 45.34 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.274 1.43 . . . . 0.0 110.399 -174.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.83 117.41 1.75 Allowed Glycine 0 CA--C 1.523 0.557 0 C-N-CA 125.238 1.399 . . . . 0.0 112.707 -167.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 p -106.64 104.73 14.49 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.736 1.214 . . . . 0.0 112.26 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 147.73 19.33 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.633 1.587 . . . . 0.0 114.795 -173.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -44.24 -39.32 4.37 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -155.2 177.42 11.36 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.777 1.631 . . . . 0.0 110.333 165.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -45.23 -41.39 8.37 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 127.422 2.289 . . . . 0.0 116.159 -174.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 -13.87 1.74 Allowed 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.5 tp -125.98 -42.71 1.87 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.439 2.295 . . . . 0.0 111.505 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.72 40.49 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.443 -1.411 . . . . 0.0 112.333 172.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -55.41 -39.77 70.62 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 117.419 -1.277 . . . . 0.0 111.932 168.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.39 -54.83 38.82 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.576 1.535 . . . . 0.0 111.667 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -54.99 -52.79 62.02 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.638 1.975 . . . . 0.0 113.661 171.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -52.62 63.11 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.622 0.769 . . . . 0.0 112.126 177.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.18 -53.65 47.51 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 125.854 1.662 . . . . 0.0 112.202 171.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -52.49 -50.4 62.81 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.634 1.574 . . . . 0.0 111.876 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.8 t -55.3 -56.45 19.91 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 113.034 171.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -61.45 2.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.771 1.229 . . . . 0.0 112.718 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.401 ' HG ' ' CE2' ' A' ' 67' ' ' PHE . 0.4 OUTLIER -46.23 -57.78 4.25 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 128.566 2.746 . . . . 0.0 111.5 176.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.89 -49.88 70.14 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.528 0.604 . . . . 0.0 111.103 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 50.2 m -55.24 -73.97 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 173.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.288 18.3 m -55.72 -44.62 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -175.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 6.6 m-30 -60.06 -44.54 94.65 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.652 -1.28 . . . . 0.0 114.149 172.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.83 -37.6 68.9 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.384 1.447 . . . . 0.0 114.439 168.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.548 0.902 0 C-N-CA 124.851 1.26 . . . . 0.0 111.594 167.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo . . . . . 0 N--CA 1.461 -0.433 0 N-CA-C 114.942 1.093 . . . . 0.0 114.942 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 90.0 t -55.04 -52.9 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 173.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -55.45 -54.77 39.68 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 127.154 2.181 . . . . 0.0 115.558 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.276 1.7 pt -59.95 -50.38 80.34 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-O 118.115 -0.945 . . . . 0.0 113.085 172.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.307 0.0 OUTLIER -55.52 -46.24 77.05 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.462 1.483 . . . . 0.0 113.521 178.692 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -46.96 -63.07 1.13 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.247 2.219 . . . . 0.0 111.809 168.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -56.28 -47.02 79.45 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 176.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.5 mt -55.67 -29.16 58.86 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.909 1.283 . . . . 0.0 114.342 171.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 35.36 60.41 2.62 Favored Pre-proline 0 N--CA 1.486 1.362 0 C-N-CA 126.782 2.033 . . . . 0.0 116.238 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -59.42 21.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.56 1.786 0 C-N-CA 125.244 3.963 . . . . 0.0 119.58 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.23 24.72 76.69 Favored Glycine 0 CA--C 1.536 1.391 0 O-C-N 119.856 -1.777 . . . . 0.0 112.775 -167.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.42 171.96 7.89 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.918 2.087 . . . . 0.0 115.032 -172.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.35 135.25 40.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.091 1.357 . . . . 0.0 111.942 158.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -104.68 135.63 45.71 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.235 1.414 . . . . 0.0 110.549 173.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -130.31 135.16 47.78 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.418 1.487 . . . . 0.0 109.906 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -107.98 128.56 54.76 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.578 1.18 . . . . 0.0 112.214 -168.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.8 151.49 52.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 129.839 3.256 . . . . 0.0 106.702 -172.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p . . . . . 0 C--N 1.322 -0.63 0 O-C-N 119.933 -1.73 . . . . 0.0 110.127 161.2 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 . . . . . 0 CA--C 1.512 -0.517 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.4 t -109.89 124.24 66.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.021 -1.445 . . . . 0.0 109.89 -169.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 63.1 mmm -104.86 124.36 49.31 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -111.38 134.02 53.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.513 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.64 135.58 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.469 0.708 . . . . 0.0 111.571 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -104.47 119.79 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 166.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.7 m -133.65 -3.03 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 -160.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -155.43 -20.11 0.11 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 -174.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.31 -18.33 28.06 Favored Glycine 0 CA--C 1.538 1.48 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -142.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -105.0 162.17 13.58 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.701 1.6 . . . . 0.0 110.841 170.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -133.68 140.05 46.81 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.254 1.822 . . . . 0.0 110.925 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.03 159.56 41.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.103 1.361 . . . . 0.0 111.532 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -135.6 134.66 39.54 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.361 1.864 . . . . 0.0 109.411 176.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.1 120.71 2.83 Favored Glycine 0 CA--C 1.523 0.551 0 C-N-CA 125.158 1.361 . . . . 0.0 111.338 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.4 p -105.01 110.47 22.88 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.648 1.179 . . . . 0.0 111.708 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.47 155.75 22.35 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.867 1.698 . . . . 0.0 114.465 -168.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -55.06 -38.74 68.41 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.801 -0.823 . . . . 0.0 113.148 174.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -151.17 -177.44 6.04 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.794 1.638 . . . . 0.0 109.193 159.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.5 mtmm -44.22 -35.04 2.08 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 127.683 2.393 . . . . 0.0 115.082 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.2 pttt -46.34 -29.91 1.87 Allowed 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.5 tp -121.3 -40.7 2.56 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.193 2.197 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.55 -52.03 65.08 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.904 1.282 . . . . 0.0 112.664 173.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -55.38 -47.93 75.07 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 117.398 -1.286 . . . . 0.0 110.866 166.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.8 73.7 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 120.471 1.487 . . . . 0.0 112.686 -176.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.4 mmm-85 -55.03 -59.77 4.3 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.885 2.874 . . . . 0.0 113.305 169.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -49.42 72.57 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.594 0.712 . . . . 0.0 112.506 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.98 -51.49 66.04 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 126.646 1.978 . . . . 0.0 112.111 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -54.94 -47.6 74.25 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.409 1.484 . . . . 0.0 111.904 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.33 -54.97 36.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.577 1.151 . . . . 0.0 112.774 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.1 -57.94 9.71 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.98 -55.06 13.05 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 128.371 2.668 . . . . 0.0 111.61 176.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.11 68.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.504 0.593 . . . . 0.0 110.92 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 27.1 m -55.47 -74.67 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 172.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.1 m -55.56 -37.28 45.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.26 4.8 m-30 -68.47 -33.61 74.48 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 171.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -55.51 -35.26 65.41 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.152 -1.592 . . . . 0.0 113.156 159.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.5 mt . . . . . 0 N--CA 1.479 0.976 0 CA-C-O 118.248 -0.882 . . . . 0.0 112.429 169.898 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 N--CA 1.46 -0.499 0 CA-C-O 118.148 -0.855 . . . . 0.0 113.786 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.0 t -54.99 -53.24 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 171.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.55 -55.47 31.59 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.271 7.3 pt -58.42 -47.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 120.735 1.607 . . . . 0.0 114.399 174.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.275 0.0 OUTLIER -55.58 -46.65 77.22 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 174.676 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -55.2 -54.69 40.16 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.464 1.905 . . . . 0.0 112.324 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -55.4 -61.1 2.56 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.548 1.939 . . . . 0.0 113.259 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.3 mt -55.62 -34.91 65.32 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 36.76 58.57 3.64 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 127.127 2.171 . . . . 0.0 114.598 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.62 65.61 1.2 Allowed 'Trans proline' 0 CA--C 1.551 1.366 0 C-N-CA 124.52 3.48 . . . . 0.0 115.253 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.58 29.48 75.26 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.787 1.661 . . . . 0.0 114.835 172.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.3 pp -105.21 166.27 10.52 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 -163.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.31 145.63 47.67 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.733 2.013 . . . . 0.0 111.886 166.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -104.56 128.92 52.66 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.686 0.795 . . . . 0.0 110.471 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -104.89 134.34 48.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.227 1.811 . . . . 0.0 109.258 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.43 ' CE1' ' HE3' ' A' ' 51' ' ' LYS . 62.9 t80 -113.17 126.11 55.08 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.784 1.278 . . . . 0.0 110.969 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.93 154.92 47.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 130.065 3.346 . . . . 0.0 106.024 -173.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.5 t . . . . . 0 C--N 1.321 -0.641 0 O-C-N 119.577 -1.952 . . . . 0.0 110.133 164.578 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 . . . . . 0 N--CA 1.442 -0.827 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.4 t -112.99 127.21 70.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 123.287 1.518 . . . . 0.0 110.22 -170.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.75 135.12 46.72 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.961 -1.472 . . . . 0.0 107.571 171.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -122.67 135.31 54.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 122.739 0.416 . . . . 0.0 110.582 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.88 135.78 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.555 -0.716 . . . . 0.0 111.529 172.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.8 t -101.09 122.07 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 160.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.97 142.75 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 127.015 2.126 . . . . 0.0 108.881 -167.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.8 t70 58.32 -67.04 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.428 1.891 . . . . 0.0 114.172 -174.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -170.11 17.97 0.07 OUTLIER Glycine 0 CA--C 1.541 1.706 0 C-N-CA 128.539 2.971 . . . . 0.0 112.827 169.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -134.96 165.81 24.48 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.767 2.427 . . . . 0.0 111.73 -168.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -134.86 128.61 32.98 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.467 1.107 . . . . 0.0 112.222 -162.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.37 136.59 43.48 Favored 'General case' 0 C--O 1.206 -1.218 0 C-N-CA 124.923 1.289 . . . . 0.0 111.956 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -104.44 134.51 47.52 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 126.719 2.008 . . . . 0.0 109.85 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.69 112.67 1.16 Allowed Glycine 0 CA--C 1.52 0.367 0 C-N-CA 124.796 1.189 . . . . 0.0 112.202 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 p -104.8 117.18 33.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.671 0.788 . . . . 0.0 111.867 -172.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.52 146.49 18.5 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 125.158 1.361 . . . . 0.0 115.489 -166.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.42 -36.04 6.13 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 168.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -157.52 178.18 10.58 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.792 2.037 . . . . 0.0 109.066 162.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.43 ' HE3' ' CE1' ' A' ' 21' ' ' PHE . 82.0 mttt -46.44 -36.4 6.54 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 126.676 1.99 . . . . 0.0 115.162 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -16.14 2.42 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.249 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.3 tp -123.31 -43.29 2.2 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.7 2.0 . . . . 0.0 110.724 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.5 -52.43 63.7 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.554 -1.341 . . . . 0.0 112.279 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -55.41 -47.28 76.16 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 117.529 -1.224 . . . . 0.0 110.677 169.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.49 -47.68 75.8 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 120.273 1.397 . . . . 0.0 112.615 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -55.48 -59.66 4.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.738 2.015 . . . . 0.0 112.03 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.35 -49.84 71.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.39 1.076 . . . . 0.0 112.092 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.23 -58.62 6.43 Favored 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 126.344 1.858 . . . . 0.0 112.406 173.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -55.31 -44.86 76.17 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.442 1.474 . . . . 0.0 111.689 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.6 m -55.26 -55.31 32.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.87 0.868 . . . . 0.0 112.505 173.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.24 -56.24 22.26 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.739 1.215 . . . . 0.0 112.329 174.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.41 -56.87 6.08 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 128.047 2.539 . . . . 0.0 111.183 176.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.15 -52.69 60.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.298 0.499 . . . . 0.0 110.762 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -71.2 0.09 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 175.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.289 24.7 m -55.26 -51.32 56.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 O-C-N 121.058 -1.026 . . . . 0.0 112.587 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -55.79 -33.93 64.84 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 121.366 1.894 . . . . 0.0 114.777 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -55.72 -38.12 69.32 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 162.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.9 mt . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 162.906 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo . . . . . 0 C--O 1.237 0.432 0 N-CA-C 113.825 0.663 . . . . 0.0 113.825 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.7 t -54.24 -50.93 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -55.71 28.44 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.09 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.0 pt -55.58 -49.2 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.821 1.191 . . . . 0.0 113.671 172.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -51.26 65.81 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.51 1.05 . . . . 0.0 112.047 177.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -55.63 -54.01 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.207 1.803 . . . . 0.0 112.72 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -59.99 -45.03 94.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -39.56 71.33 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.963 1.305 . . . . 0.0 113.359 171.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 30.85 61.11 1.05 Allowed Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 127.826 2.45 . . . . 0.0 116.241 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -53.63 -38.83 84.49 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.513 2.142 . . . . 0.0 114.918 -174.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.36 33.92 0.12 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.411 1.481 . . . . 0.0 112.258 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -77.61 151.58 34.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 117.046 2.239 . . . . 0.0 117.046 -154.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 135.8 40.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.203 2.201 . . . . 0.0 112.606 157.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.651 ' CD2' ' HE3' ' A' ' 55' ' ' LYS . 65.3 m-85 -104.86 135.58 45.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.822 1.249 . . . . 0.0 112.913 -177.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -108.12 135.73 48.98 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 128.664 2.785 . . . . 0.0 110.91 173.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -104.97 126.57 52.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.558 1.143 . . . . 0.0 111.452 171.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.7 mp -135.05 144.28 47.18 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 129.475 3.11 . . . . 0.0 106.903 -173.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p . . . . . 0 N--CA 1.477 0.892 0 O-C-N 119.31 -2.119 . . . . 0.0 111.293 149.142 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 104.146 -2.539 . . . . 0.0 104.146 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.7 t -112.98 116.55 52.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 123.103 1.43 . . . . 0.0 109.063 -161.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.8 mmt -105.14 122.94 46.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.478 -1.237 . . . . 0.0 107.859 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -128.5 135.24 49.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -172.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.2 t -135.03 135.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 120.839 -1.163 . . . . 0.0 109.724 -163.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.7 t -104.1 104.73 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 103.061 -2.941 . . . . 0.0 103.061 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.8 p -100.84 -12.39 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -152.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -167.72 -37.38 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.258 2.223 . . . . 0.0 111.643 -158.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 150.78 -25.06 1.04 Allowed Glycine 0 CA--C 1.538 1.515 0 C-N-CA 125.872 1.701 . . . . 0.0 110.72 -161.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.85 163.0 13.07 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 125.26 1.424 . . . . 0.0 110.372 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.81 138.67 53.85 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.71 1.604 . . . . 0.0 112.079 -168.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -135.11 157.67 46.34 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.166 1.786 . . . . 0.0 111.844 -172.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -139.54 133.48 30.86 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.442 1.497 . . . . 0.0 110.384 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.96 119.58 2.17 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.471 1.51 . . . . 0.0 112.305 -173.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.2 p -105.24 104.96 14.79 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.409 1.084 . . . . 0.0 112.413 -171.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.87 138.03 9.6 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 125.115 1.34 . . . . 0.0 115.766 -176.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -57.66 -12.92 3.24 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -155.5 177.85 10.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.527 1.131 . . . . 0.0 111.231 155.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -49.75 -51.76 36.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 124.834 1.253 . . . . 0.0 113.818 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -6.76 0.44 Allowed 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 177.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.3 tp -115.26 -44.74 2.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.712 1.605 . . . . 0.0 110.308 171.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.56 -59.2 5.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.876 1.271 . . . . 0.0 113.086 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.651 ' HE3' ' CD2' ' A' ' 19' ' ' TYR . 18.8 mmtm -55.45 -37.81 68.21 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 115.288 -2.291 . . . . 0.0 112.581 164.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.72 -54.67 41.43 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 123.355 2.798 . . . . 0.0 111.492 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.33 -55.43 31.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 129.089 2.956 . . . . 0.0 113.749 170.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.41 -56.62 17.99 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 111.462 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -44.97 -62.04 1.39 Allowed 'General case' 0 C--O 1.215 -0.749 0 C-N-CA 124.084 0.953 . . . . 0.0 113.161 166.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -47.53 -53.19 15.07 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.413 1.485 . . . . 0.0 112.015 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 25.1 p -55.4 -57.57 11.33 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 173.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.32 -64.25 0.9 Allowed 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 126.635 1.974 . . . . 0.0 112.014 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.9 tp -50.43 -54.45 21.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.677 2.791 . . . . 0.0 111.988 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.17 -49.39 71.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.504 0.593 . . . . 0.0 112.388 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.3 m -55.43 -60.99 2.64 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 175.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 4.8 m -55.26 -47.56 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.275 0.943 . . . . 0.0 112.707 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.85 -47.05 77.97 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -55.49 -39.72 70.79 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.732 1.213 . . . . 0.0 112.541 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.55 0.949 0 C-N-CA 124.813 1.245 . . . . 0.0 110.374 166.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo . . . . . 0 N--CA 1.488 1.175 0 N-CA-C 112.561 0.177 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.2 m -158.33 156.41 30.53 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.747 1.619 . . . . 0.0 110.708 172.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 75.97 -45.71 1.99 Allowed Glycine 0 CA--C 1.538 1.473 0 C-N-CA 125.685 1.612 . . . . 0.0 114.554 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.46 170.92 14.82 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.845 2.058 . . . . 0.0 110.994 177.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -54.82 138.67 63.07 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 123.214 0.605 . . . . 0.0 109.858 158.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -63.66 -29.7 69.61 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.896 2.397 . . . . 0.0 114.862 -172.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 71.8 t -55.09 -51.53 53.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.33 -44.26 75.69 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.072 1.349 . . . . 0.0 114.386 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mt -58.23 -57.76 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 123.829 0.851 . . . . 0.0 112.148 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -55.32 -38.54 68.84 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.601 0.715 . . . . 0.0 112.304 178.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -55.08 -61.31 2.4 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.152 1.781 . . . . 0.0 111.928 168.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -55.57 -56.47 19.99 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.05 -1.031 . . . . 0.0 113.179 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.6 mt -55.93 -29.16 59.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 117.504 2.409 . . . . 0.0 117.504 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.325 0.0 OUTLIER -9.21 75.92 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.757 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 -167.695 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -58.04 -34.55 98.55 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 122.022 1.815 . . . . 0.0 116.196 -165.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 177.55 30.12 0.04 OUTLIER Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.228 1.394 . . . . 0.0 112.123 172.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -96.51 164.14 12.74 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -161.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.12 141.28 45.96 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.634 1.574 . . . . 0.0 112.535 173.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -104.55 135.23 46.34 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.623 1.169 . . . . 0.0 111.764 -177.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -104.82 135.25 46.53 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.106 1.362 . . . . 0.0 109.685 164.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -104.43 119.94 40.1 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.103 0.954 . . . . 0.0 109.016 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 136.02 54.57 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 128.846 2.859 . . . . 0.0 106.57 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t -85.41 159.94 19.87 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 119.463 -2.023 . . . . 0.0 109.756 154.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.316 26.4 mm-40 100.04 80.34 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.072 1.749 . . . . 0.0 114.962 158.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.7 t -121.12 5.86 10.31 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.684 148.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 50.62 -159.11 1.74 Allowed Glycine 0 CA--C 1.539 1.554 0 C-N-CA 126.317 1.913 . . . . 0.0 114.812 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.82 163.34 4.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 128.739 2.815 . . . . 0.0 113.545 -10.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.3 m -70.05 18.92 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 115.585 1.698 . . . . 0.0 115.585 -175.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -130.34 -38.4 1.37 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.475 1.11 . . . . 0.0 113.95 -163.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.18 -6.2 3.86 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.844 1.258 . . . . 0.0 113.274 169.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 47.7 tptt 84.73 149.14 0.07 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 128.245 2.618 . . . . 0.0 114.306 150.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.6 m -129.6 135.2 48.27 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 123.486 1.612 . . . . 0.0 112.247 161.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -104.63 135.63 45.68 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 129.542 3.137 . . . . 0.0 104.12 173.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.92 130.09 71.19 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 122.711 1.243 . . . . 0.0 109.875 -167.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 5.4 mmt -115.09 123.87 50.11 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.532 0.733 . . . . 0.0 110.333 177.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.88 136.58 44.11 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.931 0.892 . . . . 0.0 110.443 172.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.4 m -121.98 135.87 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.114 0.566 . . . . 0.0 112.397 167.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.9 t -104.47 128.54 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 161.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . 0.305 7.7 p -126.74 -110.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 124.626 1.17 . . . . 0.0 111.508 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -81.14 45.22 0.82 Allowed 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 121.189 1.813 . . . . 0.0 114.025 -168.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.4 13.99 80.89 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.935 -1.103 . . . . 0.0 112.07 -166.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -119.09 153.1 35.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 127.013 2.125 . . . . 0.0 109.981 -171.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -134.01 134.63 42.67 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.489 1.116 . . . . 0.0 111.712 -174.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -135.24 154.65 51.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.062 1.345 . . . . 0.0 111.287 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -134.74 134.81 41.4 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.133 2.173 . . . . 0.0 108.573 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.04 122.19 2.78 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 124.828 1.204 . . . . 0.0 111.901 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.6 p -105.68 114.55 28.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.554 1.142 . . . . 0.0 111.511 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.57 145.28 17.3 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.686 1.136 . . . . 0.0 115.818 -175.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.47 -24.13 0.47 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 172.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -158.25 177.67 11.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.91 1.684 . . . . 0.0 109.699 156.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.4 mtmm -49.28 -36.2 19.99 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 126.545 1.938 . . . . 0.0 115.149 177.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -13.08 1.26 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 170.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.6 tp -125.53 -42.71 1.93 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.884 2.074 . . . . 0.0 110.862 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -54.62 41.53 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.584 -1.322 . . . . 0.0 111.61 173.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.4 ttmt -55.48 -42.5 74.45 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.071 -1.442 . . . . 0.0 111.676 167.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.34 -51.42 66.81 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 121.238 1.836 . . . . 0.0 112.838 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -55.25 -56.33 21.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 129.495 3.118 . . . . 0.0 112.493 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.22 -53.54 54.79 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.836 1.254 . . . . 0.0 112.577 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.48 -56.46 9.69 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 126.409 1.884 . . . . 0.0 112.037 170.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -53.81 -48.0 70.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.697 1.599 . . . . 0.0 112.452 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.1 m -55.29 -57.92 9.84 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.581 1.152 . . . . 0.0 112.743 172.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -58.22 8.58 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.63 1.172 . . . . 0.0 111.762 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -40.23 -59.43 1.28 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.416 2.687 . . . . 0.0 110.86 173.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.81 -56.66 15.52 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.174 0.443 . . . . 0.0 111.489 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 93.0 m -55.25 -70.35 0.11 Allowed 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 176.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.259 12.0 m -55.46 -40.85 60.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.8 m-30 -60.46 -40.24 90.47 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.166 -1.584 . . . . 0.0 114.212 170.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -35.14 65.23 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.262 1.392 . . . . 0.0 114.456 162.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt -71.96 -16.47 62.09 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.829 0.741 . . . . 0.0 112.999 169.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.1 m-70 66.42 41.62 3.2 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 127.802 2.441 . . . . 0.0 111.761 -174.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--O 1.253 1.241 0 C-N-CA 126.908 2.083 . . . . 0.0 111.297 -168.014 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 CA--C 1.538 0.716 0 N-CA-C 112.649 0.211 . . . . 0.0 112.649 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 m -67.99 29.97 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 127.996 2.518 . . . . 0.0 116.806 -168.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 64.65 20.49 66.12 Favored Glycine 0 CA--C 1.538 1.516 0 O-C-N 120.38 -1.45 . . . . 0.0 112.918 -165.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.0 tttt -59.38 133.74 56.37 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 127.172 2.189 . . . . 0.0 112.608 -168.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -133.71 175.4 3.71 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 126.783 2.033 . . . . 0.0 109.242 -179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.5 -38.66 32.01 Favored 'Trans proline' 0 C--N 1.347 0.494 0 CA-C-N 121.539 1.586 . . . . 0.0 113.933 -173.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 86.4 t -55.18 -49.34 72.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -46.85 75.98 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.0 mt -55.85 -56.17 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 119.611 1.096 . . . . 0.0 111.212 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.436 HD23 ' HH ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -54.83 -43.73 73.26 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.127 0.971 . . . . 0.0 112.719 -179.672 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -56.22 -58.02 9.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 127.006 2.122 . . . . 0.0 112.501 172.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -55.21 -55.02 36.04 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.81 2.044 . . . . 0.0 112.359 177.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mt -55.97 -38.15 70.01 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 171.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.288 0.0 OUTLIER 24.11 65.39 0.4 Allowed Pre-proline 0 N--CA 1.488 1.459 0 C-N-CA 127.399 2.28 . . . . 0.0 115.156 -168.724 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.53 55.93 3.83 Favored 'Trans proline' 0 CA--C 1.549 1.249 0 C-N-CA 124.811 3.674 . . . . 0.0 113.566 -173.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 63.19 24.27 67.05 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 125.8 1.666 . . . . 0.0 115.431 173.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 pp -90.62 173.3 8.12 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.494 1.147 . . . . 0.0 112.998 -172.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -133.26 134.93 44.58 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.823 0.849 . . . . 0.0 111.19 169.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.436 ' HH ' HD23 ' A' ' 10' ' ' LEU . 10.5 m-85 -104.49 135.3 46.17 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.59 1.556 . . . . 0.0 109.888 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -123.3 135.53 54.26 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 126.822 2.049 . . . . 0.0 109.793 179.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -104.72 130.42 52.79 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 122.754 1.264 . . . . 0.0 111.906 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.08 157.35 47.16 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 129.617 3.167 . . . . 0.0 108.386 -171.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.4 p -126.07 140.21 52.77 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 125.489 1.516 . . . . 0.0 111.656 172.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 85.54 78.04 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 127.738 2.415 . . . . 0.0 115.44 165.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.0 t -63.78 -28.28 69.76 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 117.218 2.303 . . . . 0.0 117.218 166.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.01 2.85 80.12 Favored Glycine 0 N--CA 1.472 1.059 1 C-N-CA 131.907 4.575 . . . . 0.0 115.501 -7.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 48.62 50.23 17.41 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 119.025 1.413 . . . . 0.0 110.296 -174.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.6 m -62.33 10.12 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 129.129 2.972 . . . . 0.0 117.671 -151.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -58.58 -32.28 68.81 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 121.314 -0.866 . . . . 0.0 111.175 157.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.5 -59.29 0.07 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 163.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? -165.8 145.25 6.31 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.203 1.001 . . . . 0.0 112.219 -166.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -135.26 137.79 42.88 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 126.514 1.926 . . . . 0.0 110.766 174.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -104.35 135.45 45.77 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 104.038 -2.578 . . . . 0.0 104.038 166.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.6 t -115.17 130.32 69.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 122.153 0.978 . . . . 0.0 108.976 -168.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 52.7 mmm -117.03 119.45 35.32 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.513 0.725 . . . . 0.0 109.797 177.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.97 138.37 41.29 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.883 1.273 . . . . 0.0 110.207 177.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -133.14 136.0 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.28 -0.887 . . . . 0.0 111.866 -177.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.35 127.07 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 161.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.3 141.93 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.897 1.679 . . . . 0.0 108.787 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.7 t70 56.65 -79.92 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 126.225 1.81 . . . . 0.0 113.698 -173.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -161.75 24.99 0.24 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 129.049 3.214 . . . . 0.0 110.418 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -124.35 156.68 36.62 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.182 2.593 . . . . 0.0 109.05 -169.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -134.61 136.93 43.27 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.952 0.901 . . . . 0.0 111.4 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -135.1 159.54 41.2 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.17 0.988 . . . . 0.0 111.736 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -131.12 129.21 41.55 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.727 2.011 . . . . 0.0 108.388 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.77 117.86 3.02 Favored Glycine 0 C--O 1.227 -0.301 0 C-N-CA 124.828 1.204 . . . . 0.0 110.293 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 p -104.72 116.32 31.83 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.475 1.11 . . . . 0.0 109.421 -173.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -142.32 135.89 6.9 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 120.941 -1.1 . . . . 0.0 115.592 -179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.9 ttt85 -40.6 -22.9 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 170.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -153.53 -177.98 6.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.483 1.113 . . . . 0.0 111.16 147.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 35.4 mtmt -49.24 -37.5 23.54 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 126.644 1.978 . . . . 0.0 114.797 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -13.91 1.69 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 171.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.6 tp -121.58 -44.48 2.34 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.99 2.116 . . . . 0.0 110.26 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.66 -57.19 13.01 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 125.666 1.586 . . . . 0.0 112.4 175.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -55.23 -44.28 75.32 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 116.507 -1.711 . . . . 0.0 110.936 168.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.57 -50.93 68.78 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 121.924 2.147 . . . . 0.0 112.741 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.6 mmm-85 -54.54 -58.6 6.86 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.146 2.178 . . . . 0.0 111.555 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.66 -54.16 47.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.941 0.897 . . . . 0.0 112.872 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.92 -55.85 15.19 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 126.88 2.072 . . . . 0.0 112.863 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -47.88 74.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 121.019 1.736 . . . . 0.0 111.406 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.0 m -55.05 -53.61 53.62 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.215 0.606 . . . . 0.0 112.049 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.06 -59.59 4.55 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.398 1.479 . . . . 0.0 111.734 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.43 -63.46 0.82 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 128.37 2.668 . . . . 0.0 110.627 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.95 -49.92 70.19 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.018 0.527 . . . . 0.0 111.082 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 46.4 m -55.24 -71.35 0.09 Allowed 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.276 11.4 m -55.59 -44.22 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.721 1.208 . . . . 0.0 114.062 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -55.97 -47.97 76.69 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 170.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -36.43 69.01 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.249 1.386 . . . . 0.0 113.903 168.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -38.1 89.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.405 1.082 . . . . 0.0 111.273 172.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.296 17.3 m-70 99.56 43.4 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 131.399 3.88 . . . . 0.0 112.276 175.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 43.6 tp . . . . . 0 C--O 1.252 1.216 0 C-N-CA 127.4 2.28 . . . . 0.0 110.258 171.594 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 CA--C 1.541 0.87 0 N-CA-C 113.812 0.658 . . . . 0.0 113.812 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.0 p -81.11 -8.09 59.69 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -152.85 -173.4 22.2 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.893 1.235 . . . . 0.0 114.263 175.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -141.89 28.84 1.72 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 -163.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -116.8 141.19 27.83 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 126.303 1.841 . . . . 0.0 108.287 171.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -70.06 -39.74 5.61 Favored 'Trans proline' 0 C--N 1.349 0.603 0 CA-C-N 120.915 1.363 . . . . 0.0 113.607 -169.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 59.9 t -54.46 -52.95 34.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -55.91 -53.02 61.93 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 116.051 1.871 . . . . 0.0 116.051 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.1 pt -57.66 -48.21 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.27 0.941 . . . . 0.0 113.507 171.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -55.71 -41.51 73.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 174.455 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.13 -56.67 17.28 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.527 1.931 . . . . 0.0 111.804 171.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.274 1.8 pt-20 -57.39 -59.78 4.63 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 175.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -55.8 -33.71 64.66 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 176.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.277 0.0 OUTLIER 15.04 67.87 0.16 Allowed Pre-proline 0 N--CA 1.487 1.415 0 C-N-CA 129.523 3.129 . . . . 0.0 118.092 -175.633 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.17 43.14 0.09 OUTLIER 'Trans proline' 0 CA--C 1.558 1.683 1 C-N-CA 125.921 4.414 . . . . 0.0 118.848 -175.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.45 32.85 24.05 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 120.065 -1.647 . . . . 0.0 113.771 177.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -103.8 166.63 10.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -166.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -134.79 138.77 44.57 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.922 2.089 . . . . 0.0 111.692 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -104.54 135.26 46.29 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.715 1.206 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -118.51 135.27 54.49 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 127.619 2.368 . . . . 0.0 109.261 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -108.66 124.78 51.05 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 122.331 1.062 . . . . 0.0 111.874 -174.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -131.9 167.51 19.49 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 129.895 3.278 . . . . 0.0 106.309 -173.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.9 p -141.51 168.82 18.85 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 119.937 -1.727 . . . . 0.0 113.168 159.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.278 3.4 tp10 122.92 7.34 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 128.223 2.609 . . . . 0.0 113.65 142.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -62.44 32.93 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 130.205 3.402 . . . . 0.0 115.989 175.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.4 169.66 16.46 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 126.277 1.894 . . . . 0.0 113.597 -170.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -69.22 170.25 10.54 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.684 1.194 . . . . 0.0 113.193 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 72.8 p -70.36 40.26 0.05 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 125.727 1.611 . . . . 0.0 113.102 162.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -153.5 -40.11 0.1 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.558 1.943 . . . . 0.0 112.63 -171.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -154.55 154.43 33.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.918 0.887 . . . . 0.0 112.9 -176.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -64.62 158.12 25.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.322 1.449 . . . . 0.0 114.347 -178.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.3 m -135.22 135.6 41.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.57 152.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -96.74 135.52 38.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 170.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.327 0.1 OUTLIER -107.53 135.02 47.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 122.745 1.26 . . . . 0.0 112.561 175.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 76.1 mmm -125.16 117.33 23.64 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.406 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.3 m -115.83 135.19 54.24 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.386 0.674 . . . . 0.0 109.709 -172.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -121.33 135.81 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.446 1.098 . . . . 0.0 112.067 -174.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.3 t -104.41 125.98 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 165.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.3 p -146.71 145.37 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 126.878 2.071 . . . . 0.0 109.095 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.5 t70 62.16 -23.66 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 130.62 3.78 4.52 Favored Glycine 0 CA--C 1.544 1.87 0 C-N-CA 126.569 2.033 . . . . 0.0 113.585 -167.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -135.02 165.7 24.74 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.192 2.197 . . . . 0.0 111.832 -173.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.23 137.22 44.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.365 1.066 . . . . 0.0 112.689 -163.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -135.03 150.72 50.35 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.131 1.773 . . . . 0.0 110.809 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.53 110.55 10.56 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.288 1.035 . . . . 0.0 110.557 -174.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.97 109.1 3.21 Favored Glycine 0 CA--C 1.527 0.792 0 C-N-CA 126.018 1.771 . . . . 0.0 112.018 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.0 m -108.02 104.94 14.49 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.052 0.926 . . . . 0.0 112.601 -172.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.45 136.46 7.89 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.832 1.682 . . . . 0.0 114.791 -172.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -13.63 -59.1 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 127.057 2.143 . . . . 0.0 116.739 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -136.94 177.2 8.05 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.067 1.747 . . . . 0.0 109.908 169.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -46.88 -46.01 20.82 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 120.015 1.28 . . . . 0.0 114.093 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.63 -23.43 1.7 Allowed 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 174.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -108.39 -40.19 5.21 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.235 1.414 . . . . 0.0 111.31 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.39 -56.83 15.63 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.694 1.197 . . . . 0.0 112.575 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.0 mmtt -55.41 -35.63 65.56 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 115.698 -2.096 . . . . 0.0 113.249 165.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.55 -54.81 39.36 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 122.501 2.41 . . . . 0.0 110.94 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -55.0 -53.26 58.04 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.305 2.242 . . . . 0.0 114.05 169.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.51 -56.67 17.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.225 1.01 . . . . 0.0 111.952 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.33 -60.07 2.55 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.291 1.036 . . . . 0.0 113.207 166.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -50.51 -48.43 57.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.336 1.454 . . . . 0.0 112.92 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.12 -59.16 5.15 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 112.486 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.17 -57.1 13.13 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.869 -1.062 . . . . 0.0 111.998 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -42.15 -64.32 0.61 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.288 2.635 . . . . 0.0 111.121 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.82 66.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.129 0.422 . . . . 0.0 111.092 -178.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 41.0 m -55.44 -73.17 0.06 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 175.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.253 11.6 m -55.52 -42.02 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.73 1.212 . . . . 0.0 113.845 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -56.63 -47.02 80.59 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.638 1.108 . . . . 0.0 113.4 169.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -55.3 -33.8 63.58 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 169.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt -63.4 -59.11 5.12 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.242 0.928 . . . . 0.0 110.746 167.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -169.3 -42.18 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.652 1.581 . . . . 0.0 113.896 164.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.247 0.955 0 C-N-CA 127.54 2.336 . . . . 0.0 111.152 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo . . . . . 0 CA--C 1.54 0.824 0 CA-C-O 119.565 -0.265 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.7 m 50.38 29.38 3.83 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 124.654 1.182 . . . . 0.0 113.016 -161.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 161.07 170.35 25.57 Favored Glycine 0 CA--C 1.537 1.425 0 C-N-CA 127.637 2.542 . . . . 0.0 110.824 -166.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -148.31 165.47 30.93 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.614 1.166 . . . . 0.0 113.821 -171.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -58.53 142.56 82.49 Favored Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 126.473 1.909 . . . . 0.0 113.607 -172.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.28 -37.78 5.47 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.72 2.28 . . . . 0.0 114.58 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.3 t -54.99 -50.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 122.152 0.977 . . . . 0.0 109.067 172.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.54 -49.99 71.19 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.258 10.7 pt -58.8 -48.89 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-N 120.653 1.569 . . . . 0.0 114.563 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.283 0.0 OUTLIER -55.53 -39.95 71.21 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.022 -1.049 . . . . 0.0 113.434 176.045 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -58.57 7.12 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.614 1.966 . . . . 0.0 112.117 167.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.8 -54.93 38.46 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.5 mt -55.9 -42.19 75.64 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.139 1.375 . . . . 0.0 114.584 172.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 27.38 65.17 0.59 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 128.369 2.668 . . . . 0.0 116.202 -171.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.97 74.74 0.05 OUTLIER 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 124.953 3.769 . . . . 0.0 117.117 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.86 35.15 89.73 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.691 1.615 . . . . 0.0 114.936 173.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 pp -111.81 157.46 20.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -154.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.78 141.09 44.74 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 127.419 2.288 . . . . 0.0 114.175 167.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -104.48 135.36 46.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.451 1.101 . . . . 0.0 111.44 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.58 135.43 48.12 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.909 2.083 . . . . 0.0 110.064 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -104.58 129.69 52.65 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 123.312 1.53 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -134.76 145.33 48.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 130.369 3.468 . . . . 0.0 105.944 -168.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.6 t -144.74 74.15 1.4 Allowed 'General case' 0 C--N 1.317 -0.845 0 O-C-N 118.921 -2.362 . . . . 0.0 108.264 -171.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -166.19 -12.77 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 1 N-CA-C 123.286 4.55 . . . . 0.0 123.286 -152.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -78.04 39.25 0.3 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 122.114 2.233 . . . . 0.0 113.103 -179.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.34 -146.26 5.07 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.932 1.253 . . . . 0.0 113.452 -162.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 67.77 -27.68 0.14 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 129.099 2.96 . . . . 0.0 116.195 174.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.8 t -73.81 0.36 13.42 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.221 1.408 . . . . 0.0 112.666 159.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -148.89 -59.24 0.22 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.548 1.539 . . . . 0.0 112.454 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -158.75 159.29 35.04 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.96 2.104 . . . . 0.0 109.708 176.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 tptp -62.1 133.77 55.71 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.265 0.939 . . . . 0.0 112.39 -176.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.6 m -132.26 133.51 44.19 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.615 1.166 . . . . 0.0 111.453 173.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -104.98 135.05 47.04 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 174.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 98.0 t -118.07 134.88 60.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 123.3 1.524 . . . . 0.0 109.45 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.06 124.29 46.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 171.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.3 t -120.22 134.35 55.28 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.676 0.671 . . . . 0.0 111.139 169.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -121.51 135.63 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.548 0.739 . . . . 0.0 110.322 -169.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -94.85 114.27 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.2 t -138.52 137.0 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.596 1.958 . . . . 0.0 108.337 -168.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 t70 59.02 -66.34 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.75 2.02 . . . . 0.0 114.044 -170.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 18.97 0.06 OUTLIER Glycine 0 CA--C 1.542 1.737 0 C-N-CA 128.031 2.729 . . . . 0.0 112.692 170.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -135.21 165.11 26.17 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.931 2.492 . . . . 0.0 110.944 -168.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -127.01 128.68 46.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.756 0.822 . . . . 0.0 112.508 -162.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -135.11 103.3 5.5 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.445 1.098 . . . . 0.0 113.533 -164.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -77.84 135.26 37.9 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 127.605 2.362 . . . . 0.0 110.432 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.98 123.67 3.19 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 125.948 1.737 . . . . 0.0 110.34 174.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.2 t -113.63 113.01 24.45 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.817 0.847 . . . . 0.0 111.175 -173.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.74 149.91 20.17 Favored Glycine 0 CA--C 1.529 0.939 0 C-N-CA 125.387 1.47 . . . . 0.0 115.767 -174.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -53.32 -23.01 8.17 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 175.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -157.7 -174.82 5.05 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.94 1.696 . . . . 0.0 110.288 152.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -45.19 -49.24 12.31 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.993 1.717 . . . . 0.0 114.27 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -14.15 1.13 Allowed 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.5 tp -114.66 -41.31 3.43 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.334 1.854 . . . . 0.0 111.294 172.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -55.29 33.47 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.371 174.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.5 mmtt -55.35 -41.93 73.2 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-O 115.413 -2.232 . . . . 0.0 113.593 162.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -50.19 70.59 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 123.444 2.838 . . . . 0.0 111.17 -178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -54.99 -58.16 8.77 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 129.222 3.009 . . . . 0.0 113.259 168.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -56.38 20.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.673 1.189 . . . . 0.0 112.168 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -44.86 -60.33 2.1 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.271 1.428 . . . . 0.0 114.454 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -55.01 -45.45 75.1 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.794 1.179 . . . . 0.0 112.716 -177.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.48 -56.84 15.56 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.32 1.048 . . . . 0.0 112.507 171.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -59.35 4.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.62 1.168 . . . . 0.0 112.24 177.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -57.62 5.82 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.871 2.068 . . . . 0.0 111.884 178.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.97 -49.07 72.33 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.133 0.424 . . . . 0.0 111.331 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -55.28 -68.06 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.3 m -55.47 -46.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -177.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -55.94 -48.34 75.92 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 173.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -38.07 69.08 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.054 0.843 . . . . 0.0 112.556 170.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.5 -60.18 3.9 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.504 1.122 . . . . 0.0 110.181 168.246 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -173.89 169.98 3.99 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.158 1.783 . . . . 0.0 114.32 158.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 44.8 tp . . . . . 0 C--O 1.251 1.184 0 C-N-CA 127.254 2.221 . . . . 0.0 111.198 167.819 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_exo . . . . . 0 N--CA 1.483 0.887 0 N-CA-C 110.528 -0.605 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 p 55.03 176.33 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.796 1.239 . . . . 0.0 113.124 -135.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.94 177.93 41.42 Favored Glycine 0 CA--C 1.53 1.022 0 O-C-N 121.018 -1.051 . . . . 0.0 114.037 -175.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -68.59 -8.36 41.09 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -167.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -148.13 157.2 43.2 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 125.5 1.52 . . . . 0.0 110.562 171.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -66.53 -31.83 40.73 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.41 2.073 . . . . 0.0 114.659 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 95.5 t -54.78 -50.83 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -55.29 -44.45 75.74 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.993 1.317 . . . . 0.0 114.401 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.5 mt -55.92 -59.51 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 125.254 1.422 . . . . 0.0 112.316 168.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.402 ' CD1' ' HH ' ' A' ' 19' ' ' TYR 0.264 0.0 OUTLIER -55.54 -39.31 70.4 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.696 0.798 . . . . 0.0 112.447 -179.556 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.58 -57.71 10.8 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 127.538 2.335 . . . . 0.0 112.163 168.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -55.37 -58.05 9.34 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.601 1.56 . . . . 0.0 112.001 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 13.3 mt -55.82 -35.76 66.73 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.366 0.0 OUTLIER -10.11 90.71 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.238 0 C-N-CA 127.835 2.454 . . . . 0.0 117.387 -161.883 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -66.98 -166.1 0.11 Allowed 'Trans proline' 0 CA--C 1.549 1.234 0 C-N-CA 122.457 2.105 . . . . 0.0 111.544 169.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.43 66.04 0.4 Allowed Glycine 0 CA--C 1.539 1.547 0 O-C-N 120.631 -1.293 . . . . 0.0 114.117 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 pp -112.0 167.14 10.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.848 1.659 . . . . 0.0 113.343 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -135.23 138.87 43.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.54 1.536 . . . . 0.0 112.443 167.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.402 ' HH ' ' CD1' ' A' ' 10' ' ' LEU . 19.2 m-85 -104.25 135.24 46.09 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.353 1.073 . . . . 0.0 109.62 172.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -114.08 135.33 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 127.83 2.452 . . . . 0.0 108.568 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -107.04 119.65 39.96 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.351 1.072 . . . . 0.0 111.147 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.38 150.48 45.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 129.827 3.251 . . . . 0.0 106.808 -177.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.2 p -123.93 134.19 53.57 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 120.343 -1.473 . . . . 0.0 112.068 174.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.341 6.0 mm-40 97.9 60.4 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 127.73 2.412 . . . . 0.0 115.339 162.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.0 t -64.41 114.04 4.04 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 138.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -147.03 -173.44 18.25 Favored Glycine 0 CA--C 1.539 1.537 0 O-C-N 121.386 -0.821 . . . . 0.0 114.453 -163.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.28 -146.74 0.07 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 129.101 2.96 . . . . 0.0 112.153 1.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.1 m -54.96 -15.79 2.26 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 -170.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -69.26 -36.82 77.52 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.618 1.099 . . . . 0.0 112.632 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -97.2 -43.96 7.14 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.443 1.097 . . . . 0.0 112.214 176.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 tptt 29.23 53.65 0.1 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 129.09 2.956 . . . . 0.0 114.577 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.3 m -112.88 137.19 51.61 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 126.53 1.932 . . . . 0.0 112.51 -159.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -93.86 135.74 34.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 103.994 -2.595 . . . . 0.0 103.994 177.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -116.49 114.16 45.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -158.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 72.9 mmm -104.72 118.49 36.7 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.2 m -123.72 135.29 53.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.819 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.27 135.88 53.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 123.714 0.806 . . . . 0.0 109.671 -158.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.0 t -104.13 112.85 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.0 t -137.96 136.35 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.893 2.077 . . . . 0.0 107.963 -164.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.1 t70 59.83 -65.62 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 127.213 2.205 . . . . 0.0 114.167 -171.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -174.92 20.66 0.05 OUTLIER Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.117 2.77 . . . . 0.0 112.033 174.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.09 166.84 22.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 127.248 2.219 . . . . 0.0 109.613 -167.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -121.87 138.53 54.36 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.995 0.918 . . . . 0.0 111.779 -175.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -134.77 148.3 50.2 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.083 1.753 . . . . 0.0 109.519 -173.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -133.94 131.49 39.09 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.618 1.167 . . . . 0.0 109.985 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -129.37 113.45 1.52 Allowed Glycine 0 CA--C 1.522 0.474 0 C-N-CA 125.077 1.322 . . . . 0.0 111.381 -173.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -104.81 104.69 14.51 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.115 0.966 . . . . 0.0 111.171 -172.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.01 137.97 9.54 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 124.496 1.046 . . . . 0.0 115.42 -176.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -35.76 -44.41 0.34 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 115.383 1.623 . . . . 0.0 115.383 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -139.97 179.19 6.75 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.292 1.037 . . . . 0.0 111.171 158.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 54.2 mttp -47.25 -35.1 7.25 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 126.589 1.955 . . . . 0.0 115.838 178.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.07 -15.4 5.21 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.5 tp -124.04 -41.74 2.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.267 2.227 . . . . 0.0 110.728 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.7 -58.27 8.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.967 1.307 . . . . 0.0 112.912 172.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.0 ttmt -55.25 -46.34 76.08 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-O 116.886 -1.531 . . . . 0.0 110.127 169.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.59 75.0 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 121.594 1.997 . . . . 0.0 113.174 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -55.39 -57.5 11.61 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 170.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.93 49.92 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.489 0.716 . . . . 0.0 112.574 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.19 -59.11 4.25 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.635 2.374 . . . . 0.0 112.455 172.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.12 -49.42 71.82 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.998 1.272 . . . . 0.0 111.687 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.7 m -55.42 -55.07 35.87 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.029 0.932 . . . . 0.0 112.542 175.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -55.74 27.8 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.769 1.228 . . . . 0.0 111.841 175.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.42 -57.82 2.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.481 2.312 . . . . 0.0 110.68 175.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.87 -54.17 45.98 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 122.834 0.454 . . . . 0.0 111.638 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.3 m -55.15 -68.69 0.17 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.278 21.1 m -55.51 -46.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -57.74 -46.66 84.17 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.72 -36.79 67.62 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.391 1.45 . . . . 0.0 113.635 169.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.13 -42.92 99.59 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.864 1.265 . . . . 0.0 111.466 169.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.286 25.4 m-70 103.9 39.68 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 131.393 3.877 . . . . 0.0 112.825 174.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 61.5 mt . . . . . 0 C--O 1.253 1.27 0 C-N-CA 126.598 1.959 . . . . 0.0 112.906 174.879 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo . . . . . 0 N--CA 1.489 1.255 0 N-CA-C 110.805 -0.498 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 p -59.3 160.88 6.06 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 122.079 -0.388 . . . . 0.0 111.44 139.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.5 -31.29 0.08 OUTLIER Glycine 0 CA--C 1.536 1.376 0 N-CA-C 116.376 1.31 . . . . 0.0 116.376 175.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -151.3 25.27 0.71 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.007 1.323 . . . . 0.0 112.855 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -149.07 92.33 4.36 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 126.429 1.892 . . . . 0.0 109.298 -158.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.25 -35.12 53.44 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.328 2.019 . . . . 0.0 115.275 -159.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 59.5 t -46.87 -58.59 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.117 0.967 . . . . 0.0 109.264 169.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.0 tpp -55.69 -43.91 76.85 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.7 1.6 . . . . 0.0 114.412 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.1 mt -55.59 -59.67 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.389 0.995 . . . . 0.0 110.928 173.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.28 -48.41 54.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.489 1.516 . . . . 0.0 111.236 176.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -57.89 -55.38 35.59 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 124.72 1.208 . . . . 0.0 113.881 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -56.45 -45.3 80.89 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.274 1.83 . . . . 0.0 113.765 174.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.58 -37.68 68.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.201 1.8 . . . . 0.0 112.951 169.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.8 ptt-85 34.8 66.4 1.49 Allowed Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 127.63 2.372 . . . . 0.0 114.412 -178.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.71 60.64 1.19 Allowed 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 124.922 3.748 . . . . 0.0 113.06 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.92 25.99 64.81 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.019 1.771 . . . . 0.0 115.064 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.1 pp -79.06 162.05 26.15 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 116.432 2.012 . . . . 0.0 116.432 -159.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -135.21 137.18 42.39 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.303 2.241 . . . . 0.0 110.713 164.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -104.39 135.32 46.05 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 124.587 1.18 . . . . 0.0 111.465 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -121.28 135.57 55.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 127.614 2.366 . . . . 0.0 109.68 -177.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -104.49 124.16 48.78 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 122.772 1.272 . . . . 0.0 109.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -123.84 159.46 29.53 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 130.239 3.416 . . . . 0.0 103.645 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.6 p -149.87 115.36 5.52 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 118.753 -2.467 . . . . 0.0 112.847 167.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -162.27 0.01 0.05 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.266 1.426 . . . . 0.0 113.392 -165.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.3 t -83.95 11.86 7.12 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.22 1.408 . . . . 0.0 113.552 -169.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 158.06 117.46 0.51 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.296 1.427 . . . . 0.0 110.766 -170.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -112.84 -4.04 14.05 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.29 1.036 . . . . 0.0 113.254 -172.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.6 m -75.06 48.87 0.41 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 127.544 2.338 . . . . 0.0 113.662 -174.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 26.4 t60 64.25 -32.12 0.13 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 129.426 3.091 . . . . 0.0 115.774 -172.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.96 58.9 0.16 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.614 1.966 . . . . 0.0 111.462 164.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -55.24 133.09 49.1 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.083 1.753 . . . . 0.0 112.27 -171.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.7 m -135.13 135.82 41.43 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 123.184 1.469 . . . . 0.0 113.807 -158.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -104.6 135.24 46.38 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.607 -152.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . 0.258 0.1 OUTLIER -104.96 134.5 46.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 122.843 1.306 . . . . 0.0 111.768 167.38 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 67.1 mmm -117.76 127.13 53.61 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -122.96 135.24 54.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -119.58 135.71 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 111.076 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.8 t -102.25 124.67 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 104.87 -2.27 . . . . 0.0 104.87 161.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 4.8 m -138.29 150.28 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.936 2.094 . . . . 0.0 108.159 -173.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.2 t70 54.97 -79.28 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 125.204 1.401 . . . . 0.0 113.552 -175.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -159.67 20.9 0.27 Allowed Glycine 0 CA--C 1.544 1.844 0 C-N-CA 127.988 2.709 . . . . 0.0 112.5 167.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -135.13 170.29 16.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.834 2.453 . . . . 0.0 112.583 -172.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -134.5 136.44 43.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.92 0.888 . . . . 0.0 112.991 -162.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -134.98 149.6 50.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.049 1.74 . . . . 0.0 111.102 179.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -132.27 125.95 32.24 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.897 1.279 . . . . 0.0 109.846 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.05 112.91 2.12 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 126.019 1.771 . . . . 0.0 111.569 -169.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -104.9 112.84 26.12 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.432 1.116 . . . . 0.0 111.059 -170.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.69 136.42 8.46 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 125.694 1.616 . . . . 0.0 116.702 -165.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.1 mmm-85 -55.51 -13.81 1.72 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 170.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -152.88 165.59 34.96 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 128.186 2.594 . . . . 0.0 109.139 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -51.37 -42.83 61.63 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 121.158 1.799 . . . . 0.0 113.376 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -5.7 3.44 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 174.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.58 -50.93 3.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.214 1.406 . . . . 0.0 109.067 170.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.36 -59.4 4.85 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.594 1.958 . . . . 0.0 113.459 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt -55.53 -38.34 69.11 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 115.479 -2.2 . . . . 0.0 113.081 163.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 -50.77 68.89 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 123.462 2.847 . . . . 0.0 111.944 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -55.34 -58.25 8.49 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.269 3.428 . . . . 0.0 113.347 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.4 -56.31 21.6 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.066 1.347 . . . . 0.0 111.593 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.68 -55.28 11.77 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 168.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -55.1 -47.75 74.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 120.822 1.646 . . . . 0.0 112.911 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -55.12 -56.69 16.98 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.54 1.136 . . . . 0.0 112.298 172.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -55.04 35.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.638 1.175 . . . . 0.0 112.279 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.37 -60.83 2.36 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.762 2.425 . . . . 0.0 109.8 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.09 -48.45 73.55 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.774 0.43 . . . . 0.0 111.31 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.2 m -55.37 -69.3 0.14 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.772 1.026 . . . . 0.0 113.772 173.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.4 m -55.27 -41.33 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.287 0.948 . . . . 0.0 112.957 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.23 -45.24 80.05 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.82 -1.175 . . . . 0.0 113.724 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -36.53 67.2 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 164.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.4 mt -67.89 -23.25 65.09 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 119.518 1.054 . . . . 0.0 112.598 169.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.27 12.6 m-70 77.25 45.47 0.08 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 128.772 2.829 . . . . 0.0 112.169 -175.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 tp . . . . . 0 C--O 1.25 1.093 0 C-N-CA 127.963 2.505 . . . . 0.0 111.703 -179.729 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo . . . . . 0 N--CA 1.483 0.906 0 N-CA-C 112.851 0.289 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 p -114.31 -6.16 12.95 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.085 1.354 . . . . 0.0 114.386 -173.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 179.56 169.25 39.66 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.445 1.497 . . . . 0.0 112.877 174.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -73.17 -23.77 60.48 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.977 0.911 . . . . 0.0 112.781 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -162.25 166.05 14.7 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 128.79 2.836 . . . . 0.0 108.293 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -64.53 -31.65 60.26 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 121.999 1.8 . . . . 0.0 114.77 -176.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.3 t -55.06 -50.28 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 173.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.08 -45.06 75.37 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.682 1.193 . . . . 0.0 113.208 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 12.2 mt -55.65 -63.6 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.342 1.057 . . . . 0.0 110.874 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -41.69 72.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.964 0.906 . . . . 0.0 112.842 -176.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.36 -63.64 1.1 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.093 1.757 . . . . 0.0 111.442 174.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -56.01 -48.9 75.05 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.7 mt -55.66 -35.0 65.48 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 172.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 ptt-85 33.94 59.16 1.95 Allowed Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 127.259 2.224 . . . . 0.0 115.2 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -68.01 70.78 0.84 Allowed 'Trans proline' 0 CA--C 1.548 1.203 0 C-N-CA 124.665 3.577 . . . . 0.0 114.241 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.16 30.02 74.58 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.966 1.746 . . . . 0.0 114.911 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -99.6 163.88 12.31 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 117.115 2.265 . . . . 0.0 117.115 -156.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.37 141.95 45.64 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 127.127 2.171 . . . . 0.0 112.065 161.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.428 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 29.7 m-85 -104.57 135.24 46.35 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.413 1.102 . . . . 0.0 110.874 176.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -107.46 135.73 48.44 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 128.478 2.711 . . . . 0.0 109.9 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -104.61 127.98 52.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 122.751 1.262 . . . . 0.0 110.352 174.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.9 135.83 41.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 130.014 3.326 . . . . 0.0 106.11 -171.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 t -71.83 -28.08 63.34 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 118.476 2.769 . . . . 0.0 118.476 -166.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -143.65 -36.7 0.35 Allowed 'General case' 0 N--CA 1.482 1.15 0 O-C-N 116.582 -3.824 . . . . 0.0 110.053 -45.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.9 t -75.71 77.77 2.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.311 2.245 . . . . 0.0 111.602 -171.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.77 -60.31 0.08 OUTLIER Glycine 0 CA--C 1.54 1.637 0 C-N-CA 125.108 1.337 . . . . 0.0 113.051 166.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -58.62 -49.32 77.94 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 121.106 2.453 . . . . 0.0 111.119 -10.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.4 p -92.06 -35.97 13.62 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.508 1.923 . . . . 0.0 113.444 173.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -54.91 -27.98 47.21 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.924 1.69 . . . . 0.0 114.848 -172.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -135.4 23.46 3.45 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.637 1.575 . . . . 0.0 112.335 175.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -16.74 89.73 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 129.236 3.015 . . . . 0.0 115.867 -166.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.7 m -133.37 135.75 44.91 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 126.784 2.034 . . . . 0.0 109.287 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -96.59 135.88 37.88 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.9 t -115.31 125.64 72.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 123.382 1.563 . . . . 0.0 108.696 -161.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.6 mmt -112.34 122.58 48.13 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.019 -1.446 . . . . 0.0 107.731 173.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -122.82 135.52 54.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.428 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -128.62 135.68 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.14 0.976 . . . . 0.0 111.365 -168.113 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.5 t -104.23 122.96 57.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 105.619 -1.993 . . . . 0.0 105.619 166.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -142.33 151.08 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.325 1.85 . . . . 0.0 108.37 -175.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.5 t70 58.01 -70.5 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.328 1.851 . . . . 0.0 114.13 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.22 18.45 0.09 OUTLIER Glycine 0 CA--C 1.543 1.817 0 C-N-CA 128.037 2.732 . . . . 0.0 112.946 167.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -135.33 169.45 17.46 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.756 2.422 . . . . 0.0 112.382 -168.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -134.21 138.83 45.38 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.466 1.106 . . . . 0.0 113.524 -166.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -135.12 158.75 43.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.874 1.67 . . . . 0.0 112.318 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -128.75 135.05 48.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.892 2.077 . . . . 0.0 109.449 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.86 122.21 3.13 Favored Glycine 0 CA--C 1.524 0.646 0 C-N-CA 125.494 1.521 . . . . 0.0 111.304 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 m -118.07 104.74 11.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 117.896 0.848 . . . . 0.0 110.903 -168.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 146.2 18.19 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.43 1.967 . . . . 0.0 114.347 -170.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -44.71 -33.06 1.71 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -155.51 179.31 9.3 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.881 1.672 . . . . 0.0 109.684 162.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.5 mtmt -43.39 -41.87 4.39 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 127.636 2.374 . . . . 0.0 115.709 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.99 -15.92 4.16 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 174.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -122.92 -42.48 2.29 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.931 2.092 . . . . 0.0 111.297 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.42 -57.89 10.02 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.227 1.411 . . . . 0.0 112.295 172.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -55.37 -44.46 76.05 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-O 117.586 -1.197 . . . . 0.0 110.863 170.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 -51.9 65.0 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 120.341 1.428 . . . . 0.0 113.463 178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.6 mmm-85 -55.36 -53.39 56.8 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.164 1.785 . . . . 0.0 113.24 170.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.79 65.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.97 0.908 . . . . 0.0 112.319 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.71 67.63 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 127.298 2.239 . . . . 0.0 112.403 171.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -55.01 -51.01 67.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.234 1.414 . . . . 0.0 111.822 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -55.26 -54.0 48.97 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.868 0.867 . . . . 0.0 112.812 171.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.23 -55.95 25.48 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.611 1.165 . . . . 0.0 113.19 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -59.8 3.5 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 127.826 2.45 . . . . 0.0 110.545 177.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.23 -49.6 69.07 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.177 0.298 . . . . 0.0 111.078 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 44.8 m -55.28 -72.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.541 1.136 . . . . 0.0 113.98 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.251 24.4 m -55.54 -46.17 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.8 m-30 -59.64 -44.69 93.41 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 174.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -55.58 -39.36 70.6 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.916 1.235 . . . . 0.0 113.887 168.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.61 -30.03 71.04 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.579 1.552 . . . . 0.0 112.215 167.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.303 94.2 m-70 76.46 47.31 0.08 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 128.766 2.827 . . . . 0.0 113.166 -173.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.25 1.106 0 C-N-CA 127.531 2.333 . . . . 0.0 110.078 170.531 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.541 0.826 0 N-CA-C 112.342 0.093 . . . . 0.0 112.342 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.7 p -71.56 39.74 0.07 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.656 1.982 . . . . 0.0 114.951 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -176.18 -176.86 44.73 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.966 1.269 . . . . 0.0 113.47 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.0 ttpp -66.7 -9.94 41.48 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -169.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -45.54 -57.65 7.31 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 125.657 1.583 . . . . 0.0 114.917 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.72 -31.23 26.21 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.482 2.121 . . . . 0.0 113.627 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 60.4 t -55.07 -50.3 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.165 0.893 . . . . 0.0 109.214 173.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.28 -53.6 54.07 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.944 1.298 . . . . 0.0 114.271 -177.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 15.0 pt -58.71 -49.88 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 172.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.252 0.0 OUTLIER -55.59 -45.33 77.42 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.663 1.12 . . . . 0.0 113.838 176.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.13 -56.46 19.67 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 127.106 2.163 . . . . 0.0 111.432 174.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.61 -63.82 1.05 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.111 1.364 . . . . 0.0 114.042 173.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.7 mt -55.54 -23.73 28.2 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 35.92 51.21 1.5 Allowed Pre-proline 0 N--CA 1.48 1.07 0 C-N-CA 127.557 2.343 . . . . 0.0 114.778 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.73 46.85 1.99 Allowed 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 124.657 3.571 . . . . 0.0 116.012 -156.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.04 20.16 Favored Glycine 0 CA--C 1.534 1.251 0 O-C-N 120.521 -1.362 . . . . 0.0 113.538 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -97.58 166.27 11.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.774 1.63 . . . . 0.0 114.933 -173.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.63 150.77 49.74 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.299 1.44 . . . . 0.0 112.654 145.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.55 135.83 45.25 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.842 1.257 . . . . 0.0 112.145 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -124.66 135.72 53.31 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.695 1.598 . . . . 0.0 110.266 166.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -104.42 135.14 46.42 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 123.381 1.562 . . . . 0.0 110.678 -175.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -134.5 161.74 34.21 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 131.691 3.996 . . . . 0.0 106.1 -164.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.7 m -140.81 159.82 41.39 Favored 'General case' 0 C--N 1.319 -0.759 0 O-C-N 119.64 -1.913 . . . . 0.0 112.488 158.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.313 59.3 mm-40 94.26 22.31 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 128.971 2.908 . . . . 0.0 117.283 162.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.4 m -68.2 49.16 0.06 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.561 1.544 . . . . 0.0 112.804 161.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -49.89 141.02 15.46 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.997 1.284 . . . . 0.0 112.571 -173.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -129.75 158.89 38.16 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.024 1.33 . . . . 0.0 109.779 -176.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.1 m -57.08 -10.5 1.19 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 118.483 2.772 . . . . 0.0 118.483 -148.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -132.23 1.33 3.83 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 126.155 1.782 . . . . 0.0 114.113 176.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -153.88 151.24 29.25 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 -170.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -57.24 153.56 11.82 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.779 2.032 . . . . 0.0 111.497 164.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 72.0 m -130.22 121.85 26.97 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.097 1.359 . . . . 0.0 110.854 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -104.52 135.57 45.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 104.488 -2.412 . . . . 0.0 104.488 155.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 69.2 t -120.76 130.07 74.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.29 1.043 . . . . 0.0 110.841 -159.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 13.5 mmm -109.22 123.23 48.91 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 171.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.6 p -104.88 135.62 45.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.227 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -125.25 135.47 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.788 -0.57 . . . . 0.0 111.264 172.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.3 t -104.54 124.16 58.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 165.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.4 p -152.28 140.96 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.305 1.042 . . . . 0.0 110.174 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.5 t70 62.3 -25.16 0.05 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.937 2.095 . . . . 0.0 116.327 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 133.17 -4.76 4.95 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 126.939 2.209 . . . . 0.0 112.886 -165.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -105.02 168.02 9.33 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.223 2.209 . . . . 0.0 110.808 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -135.09 139.89 45.08 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.076 1.35 . . . . 0.0 110.643 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -135.06 150.84 50.34 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.529 1.132 . . . . 0.0 111.041 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -115.29 135.09 54.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.025 1.73 . . . . 0.0 109.351 166.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.62 114.22 2.79 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 125.11 1.338 . . . . 0.0 110.373 168.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.8 p -104.83 108.86 20.57 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 122.577 1.18 . . . . 0.0 109.601 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.44 140.8 11.97 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 126.192 1.853 . . . . 0.0 113.283 -165.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -17.07 6.16 Favored 'General case' 0 CA--C 1.557 1.237 0 O-C-N 121.291 -1.123 . . . . 0.0 113.947 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -160.42 162.24 33.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 129.429 3.092 . . . . 0.0 109.584 170.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.2 mttp -43.93 -37.73 3.04 Favored 'General case' 0 N--CA 1.5 2.063 0 CA-C-N 121.707 2.048 . . . . 0.0 115.455 172.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -14.43 7.4 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 120.159 1.345 . . . . 0.0 114.218 174.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.0 tp -122.24 -40.0 2.53 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.294 2.238 . . . . 0.0 111.897 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.67 -55.25 34.33 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.405 -1.434 . . . . 0.0 111.737 173.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -55.32 -41.84 72.96 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-O 117.785 -1.102 . . . . 0.0 111.768 168.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.58 -50.78 69.17 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 120.429 1.468 . . . . 0.0 113.677 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -55.5 -54.06 48.66 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 128.563 2.745 . . . . 0.0 112.661 169.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -53.82 51.39 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.869 1.268 . . . . 0.0 111.672 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.43 -56.82 8.39 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 126.794 2.038 . . . . 0.0 112.269 169.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -52.64 -49.41 65.24 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.112 1.365 . . . . 0.0 112.525 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.22 -57.94 9.72 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.105 1.362 . . . . 0.0 112.165 173.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -56.73 16.62 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.651 1.18 . . . . 0.0 112.354 176.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.5 -63.82 0.82 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 128.208 2.603 . . . . 0.0 110.82 176.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.48 -51.65 62.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 117.82 0.282 . . . . 0.0 110.94 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.0 m -55.3 -78.25 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 15.8 m -55.25 -45.75 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.433 1.015 . . . . 0.0 113.179 -174.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -57.64 -45.42 85.49 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.755 -1.215 . . . . 0.0 112.539 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . 0.319 8.1 t-20 -57.26 -31.25 65.39 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 164.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.1 mt -61.81 -28.64 69.61 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.709 1.14 . . . . 0.0 113.647 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -84.94 -31.66 23.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.081 1.352 . . . . 0.0 114.191 174.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.495 1.518 . . . . 0.0 112.731 177.436 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 N--CA 1.483 0.912 0 N-CA-C 109.245 -1.098 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.1 m -107.53 1.28 23.27 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -129.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -179.09 162.82 29.98 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.222 0.915 . . . . 0.0 113.154 170.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -68.5 10.22 0.27 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -125.32 123.7 25.17 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.901 1.28 . . . . 0.0 110.224 -166.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.16 -25.59 57.93 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.132 2.555 . . . . 0.0 115.366 -168.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.1 t -53.87 -53.65 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.26 0.936 . . . . 0.0 109.208 173.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.3 ttt -55.53 -41.05 72.64 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.352 1.861 . . . . 0.0 114.728 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.1 mt -62.2 -59.21 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.789 1.635 . . . . 0.0 112.727 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -55.48 -35.97 66.11 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.622 0.769 . . . . 0.0 112.426 177.953 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -55.54 -58.37 8.05 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.954 1.702 . . . . 0.0 112.945 162.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.45 -49.69 71.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.038 -1.664 . . . . 0.0 113.317 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.0 mt -55.91 -42.38 75.94 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 170.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 11.12 80.05 0.06 OUTLIER Pre-proline 0 N--CA 1.49 1.526 0 C-N-CA 129.158 2.983 . . . . 0.0 115.321 -175.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -68.97 -173.18 0.57 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.612 2.208 . . . . 0.0 110.516 161.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -71.36 39.9 0.59 Allowed Glycine 0 CA--C 1.541 1.682 0 C-N-CA 125.202 1.382 . . . . 0.0 115.168 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -78.6 163.31 25.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.655 1.582 . . . . 0.0 112.968 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -135.54 135.95 40.77 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.557 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -104.37 135.55 45.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.033 1.333 . . . . 0.0 111.046 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.52 135.91 50.45 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 129.415 3.086 . . . . 0.0 110.367 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -104.32 128.21 52.09 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 122.66 1.219 . . . . 0.0 109.984 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.8 mp -135.03 135.74 41.56 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 129.244 3.018 . . . . 0.0 106.599 -170.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -67.31 -38.69 85.35 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -160.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -145.24 -49.08 0.24 Allowed 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 124.842 3.474 . . . . 0.0 110.099 -43.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.1 t -71.85 33.25 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 128.253 2.621 . . . . 0.0 114.356 -173.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -178.58 14.31 0.03 OUTLIER Glycine 0 CA--C 1.53 1.019 0 O-C-N 120.533 -1.355 . . . . 0.0 114.788 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -61.2 -10.81 7.28 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 118.884 1.342 . . . . 0.0 114.434 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 65.7 p -63.56 -18.4 63.82 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.371 1.869 . . . . 0.0 115.094 168.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 135.44 -32.19 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.432 1 C-N-CA 132.5 4.32 . . . . 0.0 110.519 -179.462 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.92 46.99 0.14 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 126.171 1.788 . . . . 0.0 113.581 178.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -43.99 122.65 2.95 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 128.534 2.734 . . . . 0.0 115.582 -161.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.1 m -134.52 135.78 42.6 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.713 2.005 . . . . 0.0 107.194 167.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -103.34 135.84 44.23 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 177.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.0 t -110.14 122.45 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 CA-C-N 113.384 -1.735 . . . . 0.0 106.793 -169.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 69.0 mmm -113.62 128.79 56.56 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 172.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -131.7 135.14 46.62 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.681 0.613 . . . . 0.0 110.185 -175.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -127.48 135.75 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 121.03 -1.044 . . . . 0.0 110.37 -167.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.16 118.26 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 105.115 -2.179 . . . . 0.0 105.115 168.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -118.69 -35.95 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.349 -159.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -131.26 -13.6 3.45 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.265 . . . . 0.0 113.884 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.33 -17.19 29.07 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 123.905 0.764 . . . . 0.0 112.096 -147.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -104.69 158.92 16.17 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 125.231 1.412 . . . . 0.0 110.747 163.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -135.08 141.09 46.0 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.043 1.737 . . . . 0.0 111.581 -161.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -134.99 127.54 30.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.977 1.311 . . . . 0.0 111.62 -171.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -99.23 135.17 41.02 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.215 1.806 . . . . 0.0 109.251 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.05 115.96 1.48 Allowed Glycine 0 CA--C 1.525 0.669 0 O-C-N 121.65 -0.656 . . . . 0.0 113.381 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.7 p -104.89 104.73 14.54 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.18 1.392 . . . . 0.0 111.533 -174.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.95 147.27 19.12 Favored Glycine 0 CA--C 1.528 0.906 0 N-CA-C 116.266 1.266 . . . . 0.0 116.266 -173.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -47.91 -26.33 1.67 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -152.83 -174.26 4.86 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.824 1.25 . . . . 0.0 109.344 149.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.6 mtmp? -42.36 -38.92 1.99 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 126.522 1.929 . . . . 0.0 114.234 172.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -45.61 -30.09 1.41 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.482 1.913 . . . . 0.0 115.52 171.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.5 tp -122.28 -36.49 2.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 111.466 -175.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.72 -56.31 22.02 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.39 1.476 . . . . 0.0 112.154 170.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.2 ttmt -55.02 -46.08 75.22 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 117.228 -1.368 . . . . 0.0 109.425 169.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -49.19 72.85 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 120.664 1.574 . . . . 0.0 113.064 -179.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -55.35 -57.36 12.17 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.824 0.849 . . . . 0.0 113.209 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.47 66.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.308 0.643 . . . . 0.0 112.325 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.39 -53.77 49.55 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.969 2.508 . . . . 0.0 113.372 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -55.3 -51.44 66.68 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.149 1.34 . . . . 0.0 111.389 176.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.2 m -55.38 -49.34 72.57 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.598 1.159 . . . . 0.0 112.115 177.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -65.7 0.54 Allowed 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.393 1.477 . . . . 0.0 111.477 170.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -37.47 -57.71 0.91 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.704 2.002 . . . . 0.0 111.988 177.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.12 -62.55 1.59 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 m -55.45 -54.17 47.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 49.8 t -55.02 -62.98 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 127.391 2.276 . . . . 0.0 109.733 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -57.29 -42.14 81.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.78 -38.66 70.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.839 0.856 . . . . 0.0 112.448 170.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.0 -62.94 1.5 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.124 0.969 . . . . 0.0 109.9 165.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -177.96 168.71 2.03 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.993 2.517 . . . . 0.0 112.668 161.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 pt? . . . . . 0 C--O 1.252 1.227 0 C-N-CA 126.682 1.993 . . . . 0.0 111.958 164.078 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo . . . . . 0 N--CA 1.486 1.045 0 N-CA-C 112.745 0.248 . . . . 0.0 112.745 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.6 m -73.25 51.08 0.31 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.577 1.951 . . . . 0.0 114.944 -174.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -155.78 161.78 30.84 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 125.488 1.518 . . . . 0.0 112.486 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 49.5 tttt 43.01 -103.7 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.264 1.826 . . . . 0.0 111.771 -167.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -157.71 140.76 10.9 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 127.399 2.279 . . . . 0.0 107.847 166.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.7 -39.52 3.42 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 121.709 1.606 . . . . 0.0 114.01 -170.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.3 t -53.82 -54.96 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 122.351 1.072 . . . . 0.0 108.124 171.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 tpt -55.62 -50.38 70.31 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 126.274 1.83 . . . . 0.0 115.816 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 9.6 pt -57.72 -51.15 73.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 120.768 1.622 . . . . 0.0 113.576 167.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.302 0.0 OUTLIER -55.57 -45.02 77.37 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.02 1.282 . . . . 0.0 114.094 179.459 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -55.32 -53.95 49.73 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.998 2.519 . . . . 0.0 112.685 170.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -55.51 -57.06 13.48 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.478 1.111 . . . . 0.0 113.153 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.39 -44.77 76.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.92 1.688 . . . . 0.0 114.769 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 35.43 65.81 1.76 Allowed Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.245 1.818 . . . . 0.0 114.93 -168.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.53 78.53 0.18 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.317 2.678 . . . . 0.0 113.196 168.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.61 27.54 66.34 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 126.362 1.934 . . . . 0.0 115.992 171.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 pp -106.35 158.16 17.08 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 117.318 2.34 . . . . 0.0 117.318 -155.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 135.87 40.02 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 127.691 2.396 . . . . 0.0 113.608 168.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -104.59 135.4 46.06 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.293 1.037 . . . . 0.0 111.437 176.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -104.89 135.65 45.84 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.354 1.862 . . . . 0.0 109.186 164.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -104.64 130.8 52.61 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 122.764 1.268 . . . . 0.0 110.513 170.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.54 151.28 49.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 129.741 3.216 . . . . 0.0 106.025 -172.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.4 m -115.51 129.46 56.55 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 120.843 -1.16 . . . . 0.0 109.025 149.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -156.56 -61.17 0.1 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 118.163 -1.415 . . . . 0.0 113.132 -168.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.5 t -49.19 138.04 12.94 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.481 1.513 . . . . 0.0 111.297 -175.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 175.62 32.03 0.04 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.465 1.031 . . . . 0.0 113.482 -162.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.23 -73.16 0.52 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.144 1.378 . . . . 0.0 112.213 -164.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.9 t -66.28 -24.74 66.61 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.507 1.123 . . . . 0.0 112.518 167.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -149.52 127.83 12.15 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 128.748 2.819 . . . . 0.0 108.037 -174.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.55 -27.99 69.01 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 116.911 2.189 . . . . 0.0 116.911 -156.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -156.71 126.83 6.43 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.129 0.877 . . . . 0.0 112.605 166.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -135.36 147.05 48.96 Favored 'General case' 0 C--O 1.248 1.0 0 C-N-CA 127.281 2.233 . . . . 0.0 112.924 169.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -101.48 131.38 47.65 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 177.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 25.6 t -108.57 131.63 58.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.909 -160.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.7 mmt -104.7 124.23 49.01 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 169.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.16 134.79 55.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.4 135.81 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.503 -169.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.1 t -104.22 120.6 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.3 t -142.99 134.05 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.91 1.684 . . . . 0.0 108.863 -162.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 t70 56.66 -66.93 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 127.751 2.42 . . . . 0.0 113.854 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.68 19.26 0.06 OUTLIER Glycine 0 CA--C 1.54 1.618 0 C-N-CA 128.576 2.989 . . . . 0.0 111.942 174.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -126.62 176.33 7.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.959 2.504 . . . . 0.0 109.252 -170.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -130.67 134.67 47.13 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.996 0.919 . . . . 0.0 111.901 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -135.0 150.24 50.31 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.416 1.486 . . . . 0.0 111.177 -173.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.23 135.1 30.36 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.474 1.11 . . . . 0.0 111.019 -173.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.79 120.73 2.73 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.731 1.634 . . . . 0.0 111.048 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 p -104.96 104.69 14.48 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.421 1.088 . . . . 0.0 110.47 -176.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.56 135.72 8.03 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 115.044 0.778 . . . . 0.0 115.044 -166.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -62.27 -1.98 0.88 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 170.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -161.2 158.56 27.58 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.561 2.344 . . . . 0.0 108.963 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -55.56 -32.73 63.26 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 121.028 1.74 . . . . 0.0 114.943 170.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -5.32 5.19 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 121.629 2.013 . . . . 0.0 115.247 169.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.7 tp -117.85 -52.44 2.43 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.412 1.885 . . . . 0.0 110.53 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.3 -53.89 50.38 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.372 1.469 . . . . 0.0 112.501 173.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -55.5 -47.79 75.65 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 117.462 -1.256 . . . . 0.0 112.294 168.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -48.51 74.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 120.474 1.488 . . . . 0.0 112.529 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.6 mmm-85 -54.96 -59.47 4.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 129.228 3.011 . . . . 0.0 113.291 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -50.2 70.41 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.924 0.89 . . . . 0.0 112.457 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.93 -52.3 63.39 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 126.245 1.818 . . . . 0.0 112.8 172.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -52.65 -50.47 63.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.941 1.696 . . . . 0.0 111.843 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.2 m -55.33 -55.08 35.66 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.646 1.178 . . . . 0.0 112.193 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.05 -61.12 2.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 112.224 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -44.64 -60.12 2.15 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.791 2.436 . . . . 0.0 111.49 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.29 -53.25 56.35 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 117.886 0.312 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.8 m -55.25 -73.83 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.264 4.9 m -55.66 -47.11 79.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 124.8 1.24 . . . . 0.0 114.081 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -57.15 -47.23 81.69 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -55.45 -38.37 68.94 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.665 1.12 . . . . 0.0 112.946 172.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -60.63 3.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.001 1.32 . . . . 0.0 110.36 167.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -172.59 -43.48 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.181 1.792 . . . . 0.0 113.578 161.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 76.5 mt . . . . . 0 C--O 1.252 1.206 0 C-N-CA 127.817 2.447 . . . . 0.0 112.45 -167.527 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 CA--C 1.544 0.989 0 N-CA-C 112.524 0.163 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.6 t -68.74 -49.65 57.09 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.548 1.939 . . . . 0.0 113.507 0.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.35 -1.03 72.63 Favored Glycine 0 CA--C 1.542 1.738 0 C-N-CA 124.522 1.058 . . . . 0.0 114.91 -172.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.8 pttt -152.21 146.03 25.13 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.259 2.224 . . . . 0.0 111.051 -174.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -66.52 152.29 95.06 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.583 1.153 . . . . 0.0 110.904 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.95 -36.53 38.21 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.564 1.509 . . . . 0.0 114.355 -171.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 13.3 t -55.1 -48.76 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -43.35 75.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.04 1.336 . . . . 0.0 114.525 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.5 mt -55.89 -61.06 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.744 1.218 . . . . 0.0 111.517 168.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.258 0.0 OUTLIER -55.27 -37.85 67.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.787 0.803 . . . . 0.0 112.806 -179.194 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -55.4 -56.98 13.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.954 2.102 . . . . 0.0 113.263 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -55.3 -53.33 57.53 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.95 2.1 . . . . 0.0 112.508 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -40.95 72.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.588 2.755 . . . . 0.0 115.078 173.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.331 0.0 OUTLIER 5.42 80.81 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 129.337 3.055 . . . . 0.0 118.055 -168.371 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.05 -175.83 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 124.311 3.341 . . . . 0.0 114.995 163.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.03 83.03 0.07 OUTLIER Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.121 -0.987 . . . . 0.0 111.507 162.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.32 160.7 33.14 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -175.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -135.7 135.78 40.34 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.826 2.05 . . . . 0.0 113.438 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -104.53 135.55 45.73 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.805 1.242 . . . . 0.0 110.668 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -125.99 135.73 52.16 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.91 2.084 . . . . 0.0 109.985 -178.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -104.63 131.47 52.02 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.509 1.147 . . . . 0.0 111.332 -172.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -134.94 135.63 41.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 128.848 2.859 . . . . 0.0 107.342 -175.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 p -85.01 151.17 24.38 Favored 'General case' 0 C--N 1.319 -0.741 0 O-C-N 119.86 -1.775 . . . . 0.0 112.663 159.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.284 5.1 tp10 89.02 52.64 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 116.765 2.135 . . . . 0.0 116.765 142.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.7 t -72.72 50.04 0.24 Allowed 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 122.782 1.277 . . . . 0.0 111.158 153.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.47 -177.05 1.32 Allowed Glycine 0 CA--C 1.53 1.02 0 C-N-CA 129.456 3.408 . . . . 0.0 120.559 175.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -120.53 -23.04 6.2 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 113.607 -1.297 . . . . 0.0 114.369 -151.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.1 m -63.03 -14.93 54.14 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 115.867 1.803 . . . . 0.0 115.867 -159.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -153.1 -37.68 0.1 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.439 1.496 . . . . 0.0 111.002 162.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.33 -52.0 11.86 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -173.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? 47.53 88.78 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.358 1.463 . . . . 0.0 110.451 -156.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 54.5 m -104.36 135.29 46.08 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.619 0.723 . . . . 0.0 112.408 -156.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -104.66 135.4 46.13 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 105.315 -2.106 . . . . 0.0 105.315 161.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -122.57 115.79 47.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.14 -157.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 82.1 mmm -104.9 117.34 33.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.834 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p -104.88 135.52 46.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.778 177.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.12 135.55 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.673 -0.642 . . . . 0.0 110.207 -172.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.2 t -104.27 116.46 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 169.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 63.1 t -137.67 123.33 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.487 1.515 . . . . 0.0 108.46 -165.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.8 t70 63.88 -29.44 0.1 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 127.244 2.218 . . . . 0.0 116.2 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 139.93 -5.81 2.82 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.555 1.55 . . . . 0.0 113.056 -161.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -104.95 167.92 9.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.101 2.161 . . . . 0.0 110.117 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -134.55 139.11 45.15 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.754 0.822 . . . . 0.0 112.227 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -135.04 158.99 42.93 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.435 1.494 . . . . 0.0 112.161 -176.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -135.45 121.67 20.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.23 1.812 . . . . 0.0 108.983 171.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -114.79 105.25 1.48 Allowed Glycine 0 CA--C 1.52 0.364 0 C-N-CA 126.013 1.768 . . . . 0.0 109.644 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -105.28 104.36 14.08 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.76 0.791 . . . . 0.0 110.126 -170.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.11 136.37 8.38 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.966 1.746 . . . . 0.0 114.36 -169.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -48.35 -26.72 2.17 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.519 ' HB3' ' HE2' ' A' ' 52' ' ' LYS . 20.3 t-20 -150.36 166.29 30.49 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 125.775 1.63 . . . . 0.0 111.072 169.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -46.61 -46.84 19.94 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.355 1.434 . . . . 0.0 114.407 -175.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.519 ' HE2' ' HB3' ' A' ' 50' ' ' ASN . 0.0 OUTLIER -58.47 -5.81 0.59 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 116.096 1.887 . . . . 0.0 116.096 175.986 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.6 tp -120.11 -42.89 2.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.296 2.238 . . . . 0.0 110.869 173.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.43 -59.57 4.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.089 1.356 . . . . 0.0 112.507 171.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -55.46 -39.83 70.85 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-O 115.455 -2.212 . . . . 0.0 112.984 164.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.28 -52.1 64.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 123.37 2.805 . . . . 0.0 111.907 178.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.23 -54.29 45.28 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.503 1.921 . . . . 0.0 114.078 169.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -58.37 8.05 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.29 -51.93 13.63 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 125.034 1.334 . . . . 0.0 114.105 167.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -55.13 -51.37 66.64 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.226 1.41 . . . . 0.0 112.052 178.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.2 m -55.28 -53.06 60.82 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.705 1.202 . . . . 0.0 111.831 174.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -61.7 2.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.229 175.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.59 -60.11 2.14 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 127.3 2.24 . . . . 0.0 110.97 178.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.05 -52.4 63.31 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.212 0.205 . . . . 0.0 111.495 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 m -55.36 -69.02 0.15 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.297 32.8 m -55.39 -47.13 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -176.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -56.73 -38.53 72.5 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -55.93 -44.97 78.84 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.126 1.33 . . . . 0.0 111.659 171.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.257 3.5 pp -89.71 13.03 15.26 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 175.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.333 3.7 p80 71.73 36.18 1.27 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 128.245 2.618 . . . . 0.0 115.632 150.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.996 1.719 . . . . 0.0 113.375 167.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo . . . . . 0 CA--C 1.537 0.658 0 CA-C-O 121.388 0.495 . . . . 0.0 112.72 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t -115.89 23.65 12.09 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.786 2.034 . . . . 0.0 112.285 -164.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.61 44.42 0.11 Allowed Glycine 0 CA--C 1.538 1.488 0 N-CA-C 120.883 3.113 . . . . 0.0 120.883 -159.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -61.43 -25.61 67.33 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.925 1.863 . . . . 0.0 111.991 163.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -144.66 137.61 13.82 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 126.937 2.095 . . . . 0.0 107.629 163.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -61.61 -27.13 81.19 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.15 2.566 . . . . 0.0 114.752 -176.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 74.8 t -55.1 -48.06 76.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.464 0 CA-C-N 118.264 0.484 . . . . 0.0 109.729 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.47 -42.53 74.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.913 1.285 . . . . 0.0 114.112 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 3.5 mt -55.98 -59.26 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.299 1.04 . . . . 0.0 113.091 167.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.498 ' CD1' ' HH ' ' A' ' 19' ' ' TYR 0.27 0.0 OUTLIER -55.4 -37.5 67.67 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.348 0.659 . . . . 0.0 112.062 -179.308 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -55.35 -61.81 2.09 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.461 2.304 . . . . 0.0 112.67 164.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.52 -53.4 56.8 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.187 -0.945 . . . . 0.0 112.343 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 11.8 mt -56.92 -40.22 75.92 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 171.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.42 0.0 OUTLIER 0.91 73.52 0.04 OUTLIER Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 127.831 2.452 . . . . 0.0 117.032 -160.619 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.08 64.06 5.15 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 124.346 3.364 . . . . 0.0 113.864 -173.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.08 27.34 73.72 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.739 1.161 . . . . 0.0 114.843 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -91.66 167.82 11.93 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.749 1.619 . . . . 0.0 113.676 -171.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -135.22 136.47 41.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.456 1.502 . . . . 0.0 113.367 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.498 ' HH ' ' CD1' ' A' ' 10' ' ' LEU . 32.2 m-85 -104.32 135.4 45.85 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.045 0.938 . . . . 0.0 110.827 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -123.81 120.6 33.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.679 1.992 . . . . 0.0 109.158 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -104.95 131.56 52.3 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.551 1.14 . . . . 0.0 111.787 -167.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.38 168.48 18.51 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 126.669 1.988 . . . . 0.0 106.629 -179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.1 p -150.13 165.23 33.45 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 119.594 -1.941 . . . . 0.0 111.426 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.284 3.1 mp0 75.84 39.3 0.32 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.497 1.919 . . . . 0.0 113.015 177.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -62.26 -4.0 1.58 Allowed 'General case' 0 CA--C 1.553 1.091 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.798 152.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -169.04 161.13 34.77 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 127.262 2.363 . . . . 0.0 110.399 174.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -140.61 154.2 46.36 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.997 1.319 . . . . 0.0 111.027 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.5 m 5.32 83.19 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 129.786 3.234 . . . . 0.0 115.464 163.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -112.39 6.39 18.68 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 128.994 2.918 . . . . 0.0 114.407 17.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.09 1.2 11.63 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.017 1.327 . . . . 0.0 113.889 171.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 48.4 tptt -27.85 104.27 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 128.833 2.853 . . . . 0.0 114.847 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 71.1 m -135.36 135.22 40.53 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.519 1.128 . . . . 0.0 112.661 -172.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -104.59 135.88 45.18 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 127.84 2.456 . . . . 0.0 107.868 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.49 129.29 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-O 122.931 1.348 . . . . 0.0 114.507 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.29 125.38 53.82 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 120.678 -1.264 . . . . 0.0 110.154 -176.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.5 p -114.5 142.74 46.01 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 124.351 1.061 . . . . 0.0 111.708 177.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.18 135.94 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 120.891 -1.131 . . . . 0.0 110.973 -175.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.18 118.28 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 170.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -132.92 -33.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -158.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -137.59 13.35 2.97 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 122.221 1.01 . . . . 0.0 113.484 -160.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.29 -11.25 31.44 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -153.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -105.15 164.29 11.93 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 128.219 2.608 . . . . 0.0 110.862 175.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -129.83 138.68 51.13 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.301 1.84 . . . . 0.0 109.811 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -132.51 152.94 51.39 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.658 1.583 . . . . 0.0 109.194 -174.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -140.68 135.27 31.47 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.236 1.014 . . . . 0.0 111.178 173.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.66 122.79 4.67 Favored Glycine 0 CA--C 1.523 0.566 0 C-N-CA 126.519 2.009 . . . . 0.0 111.284 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 t -104.91 119.69 39.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.78 0.832 . . . . 0.0 110.549 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.28 149.14 20.82 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 125.104 1.335 . . . . 0.0 116.06 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -48.98 -26.16 2.37 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 175.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -161.15 -176.27 5.35 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.11 1.764 . . . . 0.0 108.78 152.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 28.5 mtmm -45.76 -38.66 7.27 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.943 2.097 . . . . 0.0 115.33 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -16.13 4.38 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 173.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.4 tp -123.38 -40.41 2.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.149 2.18 . . . . 0.0 111.786 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.69 -57.64 11.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.103 1.361 . . . . 0.0 112.291 171.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.6 ttmt -55.14 -45.82 75.65 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-O 116.61 -1.662 . . . . 0.0 109.376 169.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.44 75.44 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 121.994 2.179 . . . . 0.0 113.441 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -55.51 -57.82 10.31 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.815 0.846 . . . . 0.0 112.858 170.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.36 -52.27 64.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.082 0.953 . . . . 0.0 112.164 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.06 -58.37 6.76 Favored 'General case' 0 C--O 1.215 -0.723 0 C-N-CA 128.247 2.619 . . . . 0.0 111.978 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.04 -47.43 74.79 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 120.133 1.333 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 m -55.29 -55.63 29.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.22 1.008 . . . . 0.0 112.141 175.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -53.28 58.02 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.809 1.244 . . . . 0.0 112.839 173.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.87 -61.66 1.85 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 128.055 2.542 . . . . 0.0 110.325 176.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.31 -46.29 72.79 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 122.93 0.492 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.4 m -55.14 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.552 0.741 . . . . 0.0 112.767 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.0 m -55.45 -40.0 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -176.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -59.84 -43.76 94.44 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 113.959 172.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -35.37 65.92 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.258 1.39 . . . . 0.0 113.811 163.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt -71.2 -20.04 62.32 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 119.324 0.966 . . . . 0.0 113.334 170.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.253 10.9 m-70 76.82 44.0 0.12 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.598 2.759 . . . . 0.0 112.574 -178.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 C--O 1.247 0.959 0 C-N-CA 127.503 2.321 . . . . 0.0 111.276 178.676 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo . . . . . 0 CA--C 1.539 0.733 0 CA-C-O 121.823 0.676 . . . . 0.0 112.867 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.6 p -65.71 -24.48 66.99 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.531 1.932 . . . . 0.0 115.149 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 165.35 -176.04 41.03 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.402 1.001 . . . . 0.0 114.092 175.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -70.17 -24.83 63.21 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.753 1.221 . . . . 0.0 113.481 175.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -56.76 119.36 29.17 Favored Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.916 1.286 . . . . 0.0 111.207 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.87 -36.86 5.62 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 121.964 1.776 . . . . 0.0 113.901 -173.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 93.5 t -52.76 -55.01 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 122.664 1.221 . . . . 0.0 108.88 173.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.2 tpt -55.79 -51.49 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 10.4 pt -55.67 -47.71 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 166.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.429 ' CD1' ' HH ' ' A' ' 19' ' ' TYR 0.283 0.0 OUTLIER -55.63 -43.1 75.85 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.996 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.08 -54.59 41.2 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 112.031 172.027 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.53 -64.14 0.94 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.428 1.891 . . . . 0.0 112.739 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.281 50.6 mt -56.08 -25.21 44.45 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 116.369 1.989 . . . . 0.0 116.369 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER 22.64 61.38 0.33 Allowed Pre-proline 0 N--CA 1.491 1.583 0 C-N-CA 129.038 2.935 . . . . 0.0 116.495 -178.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.44 39.59 0.42 Allowed 'Trans proline' 0 CA--C 1.555 1.56 1 C-N-CA 125.416 4.078 . . . . 0.0 117.169 -160.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.66 32.22 13.79 Favored Glycine 0 CA--C 1.534 1.256 0 O-C-N 120.266 -1.521 . . . . 0.0 113.737 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.31 171.58 7.29 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -169.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -135.33 140.25 44.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.621 2.369 . . . . 0.0 111.513 160.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.429 ' HH ' ' CD1' ' A' ' 10' ' ' LEU . 27.2 m-85 -104.42 135.43 45.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.415 1.086 . . . . 0.0 110.841 176.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -128.9 127.67 42.26 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.565 1.546 . . . . 0.0 109.409 176.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -105.35 131.24 53.04 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.506 1.122 . . . . 0.0 111.707 -170.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.23 170.16 15.84 Favored 'General case' 0 N--CA 1.44 -0.953 0 C-N-CA 127.917 2.487 . . . . 0.0 105.584 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -147.59 169.83 18.79 Favored 'General case' 0 C--N 1.315 -0.934 0 O-C-N 119.533 -1.979 . . . . 0.0 110.56 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.255 16.3 mm-40 103.71 12.98 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 128.29 2.636 . . . . 0.0 113.094 161.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.8 t -55.98 170.87 0.28 Allowed 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 121.891 0.853 . . . . 0.0 110.745 152.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -167.06 37.82 0.24 Allowed Glycine 0 CA--C 1.532 1.144 0 C-N-CA 125.322 1.439 . . . . 0.0 111.886 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.51 -23.93 28.92 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 -168.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.9 t -142.68 2.77 1.42 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 174.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -157.4 167.86 29.02 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.813 -1.18 . . . . 0.0 112.282 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.18 -20.57 10.83 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.395 1.878 . . . . 0.0 115.91 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? -147.86 141.59 25.65 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 168.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 t -135.56 136.25 40.97 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 128.285 2.634 . . . . 0.0 111.072 171.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -103.97 135.44 45.49 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 175.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.65 135.12 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-O 123.775 1.75 . . . . 0.0 114.77 -169.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.89 130.36 56.8 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.267 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 p -119.31 135.64 54.62 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.06 0.944 . . . . 0.0 111.437 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.4 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 2.3 m -122.15 135.69 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.01 0.924 . . . . 0.0 111.534 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.7 t -104.39 127.1 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 165.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.8 p -148.32 148.68 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.429 1.491 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 t70 60.19 -66.4 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 127.452 2.301 . . . . 0.0 114.258 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -173.01 19.14 0.06 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 128.245 2.831 . . . . 0.0 112.396 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -135.27 167.37 21.14 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.576 2.35 . . . . 0.0 111.66 -168.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -134.95 136.73 42.47 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.627 1.171 . . . . 0.0 112.391 -165.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -135.09 153.92 51.86 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.898 1.679 . . . . 0.0 110.936 -175.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -137.95 135.17 35.77 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.857 1.263 . . . . 0.0 111.889 -178.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.69 106.6 0.63 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 127.368 2.413 . . . . 0.0 111.464 -172.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 p -104.74 114.55 28.83 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.695 1.247 . . . . 0.0 110.72 -177.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.97 143.23 14.65 Favored Glycine 0 CA--C 1.528 0.881 0 CA-C-N 114.412 -1.267 . . . . 0.0 115.562 -170.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -30.05 -53.47 0.16 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 125.573 1.549 . . . . 0.0 114.546 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -137.94 -175.59 4.14 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.81 1.244 . . . . 0.0 110.593 159.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -45.28 -43.66 10.73 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.185 1.394 . . . . 0.0 114.479 177.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.04 -17.17 2.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 115.835 1.791 . . . . 0.0 115.835 177.244 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.4 tp -115.41 -38.48 3.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.196 1.798 . . . . 0.0 111.254 174.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.47 -54.62 41.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.514 1.126 . . . . 0.0 112.079 173.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 15.3 mmtt -55.19 -44.05 74.96 Favored 'General case' 0 C--O 1.204 -1.32 0 CA-C-O 114.91 -2.472 . . . . 0.0 112.457 162.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -47.69 75.28 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 124.324 3.238 . . . . 0.0 111.474 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -55.39 -62.85 1.4 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.452 1.901 . . . . 0.0 112.728 171.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.1 -55.72 27.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.262 1.425 . . . . 0.0 112.559 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -42.37 -63.92 0.68 Allowed 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 125.592 1.557 . . . . 0.0 114.21 165.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -45.32 75.76 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.832 1.651 . . . . 0.0 111.606 -176.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 m -55.23 -57.73 10.58 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.307 0.643 . . . . 0.0 112.296 175.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -50.87 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.287 1.035 . . . . 0.0 112.503 175.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -60.56 3.12 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.51 1.924 . . . . 0.0 111.164 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.39 -47.59 69.39 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.076 0.398 . . . . 0.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 37.6 m -55.35 -71.19 0.09 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 173.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 18.9 m -55.22 -39.93 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.281 0.946 . . . . 0.0 113.43 -177.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -56.32 -46.01 80.07 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.845 -1.159 . . . . 0.0 113.993 170.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -34.97 65.59 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 165.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 20.1 mt -69.76 -29.23 66.52 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 119.296 0.953 . . . . 0.0 112.73 170.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.291 17.6 m-70 92.46 37.85 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 130.583 3.553 . . . . 0.0 114.008 175.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 N--CA 1.482 1.147 0 C-N-CA 125.181 1.392 . . . . 0.0 114.488 171.256 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo . . . . . 0 CA--C 1.542 0.898 0 N-CA-C 112.432 0.128 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.3 p -149.17 28.35 0.82 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 127.852 2.461 . . . . 0.0 113.286 1.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.429 ' C ' ' H ' ' A' ' 5' ' ' ASN . . . 82.69 -90.02 1.51 Allowed Glycine 0 CA--C 1.527 0.795 0 C-N-CA 124.859 1.219 . . . . 0.0 113.419 178.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 58.7 -24.63 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 127.973 2.509 . . . . 0.0 115.206 -164.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.429 ' H ' ' C ' ' A' ' 3' ' ' GLY . 12.3 p30 -139.56 155.73 71.62 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 127.473 2.309 . . . . 0.0 109.605 167.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -66.34 -37.21 24.64 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.7 2.267 . . . . 0.0 115.161 -175.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.5 t -52.08 -49.69 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.085 0.554 . . . . 0.0 109.616 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -55.56 -51.81 65.85 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 179.223 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 5.0 mt -55.75 -51.19 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.643 1.11 . . . . 0.0 111.884 174.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.86 -51.44 63.61 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.561 1.144 . . . . 0.0 109.876 176.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -55.73 -52.37 64.16 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.127 1.771 . . . . 0.0 112.444 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -55.35 -60.08 3.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.044 2.138 . . . . 0.0 113.58 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.4 mt -55.89 -39.33 71.42 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 30.97 65.6 0.93 Allowed Pre-proline 0 N--CA 1.487 1.404 0 C-N-CA 128.048 2.539 . . . . 0.0 115.495 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -64.59 -34.05 53.59 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.144 2.563 . . . . 0.0 114.435 -167.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.99 25.05 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.693 1.616 . . . . 0.0 113.335 177.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 37.3 mt -58.92 136.27 57.82 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 126.58 1.952 . . . . 0.0 114.866 -165.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -135.08 135.93 41.63 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.629 1.572 . . . . 0.0 110.363 147.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.405 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 20.1 m-85 -104.67 135.28 46.36 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.664 1.228 . . . . 0.0 110.735 -178.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.68 135.59 55.08 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 128.017 2.527 . . . . 0.0 109.101 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -104.79 126.05 51.47 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 122.831 1.3 . . . . 0.0 111.618 -175.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.64 145.84 51.4 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 130.928 3.691 . . . . 0.0 105.631 -176.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -131.07 67.29 1.52 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 119.399 -2.063 . . . . 0.0 110.344 -172.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -139.43 -52.25 0.54 Allowed 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.337 -1.477 . . . . 0.0 114.336 -129.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.4 t -69.04 -178.72 1.31 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.665 1.186 . . . . 0.0 111.183 170.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.02 169.71 42.42 Favored Glycine 0 CA--C 1.528 0.863 0 O-C-N 120.821 -1.175 . . . . 0.0 114.981 174.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -145.8 149.98 35.34 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.996 2.118 . . . . 0.0 107.312 168.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.9 m -41.77 -9.31 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 131.27 3.828 . . . . 0.0 121.21 -150.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -147.42 74.94 1.34 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.774 1.63 . . . . 0.0 110.53 169.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -150.07 -4.92 0.35 Allowed 'General case' 0 CA--C 1.558 1.284 0 O-C-N 117.707 -3.121 . . . . 0.0 114.504 -1.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -150.59 152.35 33.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.934 1.294 . . . . 0.0 113.182 -163.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.8 m -135.06 135.5 41.32 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 127.98 2.512 . . . . 0.0 109.788 171.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 21.4 m-30 -95.48 130.71 42.21 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 -178.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -108.58 116.38 51.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 113.493 -1.685 . . . . 0.0 107.406 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 11.8 mmt -104.71 123.8 48.25 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 m -123.13 135.06 54.19 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.405 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 1.8 m -127.91 135.43 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.054 0.942 . . . . 0.0 111.989 -169.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.7 t -104.36 125.26 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 167.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 94.3 t -135.36 -33.86 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -158.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -149.21 26.48 0.87 Allowed 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 122.408 1.099 . . . . 0.0 111.566 -160.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.23 -15.44 8.9 Favored Glycine 0 CA--C 1.538 1.474 0 O-C-N 120.797 -1.189 . . . . 0.0 112.873 -161.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -112.1 168.76 9.35 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.769 2.027 . . . . 0.0 112.252 175.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -133.48 140.23 47.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.585 1.954 . . . . 0.0 111.106 -163.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.97 155.25 51.07 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.945 1.698 . . . . 0.0 110.762 -175.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -132.74 135.08 45.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.285 1.034 . . . . 0.0 110.581 -176.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.01 109.24 0.85 Allowed Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.106 1.336 . . . . 0.0 112.522 -166.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.7 p -104.78 104.63 14.45 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.019 0.909 . . . . 0.0 112.245 -168.363 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.17 135.93 7.62 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 116.139 1.215 . . . . 0.0 116.139 -176.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -50.46 -23.8 2.69 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -149.34 176.94 10.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.268 1.027 . . . . 0.0 110.831 157.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -47.11 -48.35 22.99 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 125.897 1.679 . . . . 0.0 114.444 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.23 -9.41 0.65 Allowed 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 176.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.8 tp -117.56 -41.73 2.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.808 2.043 . . . . 0.0 110.798 172.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.63 -59.52 4.73 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.647 1.579 . . . . 0.0 113.036 173.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -55.46 -41.58 73.12 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 115.667 -2.111 . . . . 0.0 112.532 164.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -48.97 73.22 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 122.719 2.508 . . . . 0.0 111.19 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -55.32 -58.82 6.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.728 2.011 . . . . 0.0 115.343 163.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.38 -53.71 52.86 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.766 1.166 . . . . 0.0 111.889 -176.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -40.58 -72.84 0.06 Allowed 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 117.525 -1.226 . . . . 0.0 113.634 156.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -45.27 -46.32 12.56 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.175 1.807 . . . . 0.0 113.796 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.4 m -55.27 -63.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.881 1.272 . . . . 0.0 112.895 170.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.34 -59.58 4.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.078 0.951 . . . . 0.0 112.81 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -45.27 -63.34 0.96 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.779 3.231 . . . . 0.0 111.226 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.21 -45.02 75.9 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 175.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 85.5 m -55.33 -68.46 0.19 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.583 0.629 . . . . 0.0 112.359 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.4 m -55.29 -35.32 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.409 1.004 . . . . 0.0 113.125 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -63.73 -40.56 97.03 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.616 -1.303 . . . . 0.0 114.115 175.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -55.41 -39.32 70.07 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 118.926 0.785 . . . . 0.0 112.503 162.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.0 mt -76.84 1.27 17.92 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 170.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.279 0.9 OUTLIER 70.73 24.09 4.37 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.296 1.838 . . . . 0.0 113.993 157.576 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.7 mt . . . . . 0 C--O 1.252 1.235 0 C-N-CA 127.842 2.457 . . . . 0.0 112.725 -176.12 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo . . . . . 0 CA--C 1.544 0.979 0 N-CA-C 113.189 0.419 . . . . 0.0 113.189 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 m -64.95 -12.97 55.71 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 129.338 3.055 . . . . 0.0 115.455 4.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -148.78 -164.28 11.41 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 125.806 1.67 . . . . 0.0 112.364 174.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -143.48 -44.46 0.28 Allowed 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.699 2.0 . . . . 0.0 110.588 177.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -147.02 143.53 18.44 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 127.388 2.275 . . . . 0.0 106.192 145.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.9 -30.79 10.81 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 CA-C-N 121.158 1.449 . . . . 0.0 114.962 -171.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 15.2 t -55.44 -52.98 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.666 1.121 . . . . 0.0 109.287 160.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.49 -48.93 73.81 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -176.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.4 pt -60.13 -49.68 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.586 1.085 . . . . 0.0 111.805 169.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.348 0.0 OUTLIER -55.94 -39.37 71.6 Favored 'General case' 0 N--CA 1.461 0.094 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 177.666 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -55.54 -60.2 3.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.619 1.968 . . . . 0.0 109.426 169.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -55.2 -59.2 5.11 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.438 1.495 . . . . 0.0 113.999 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.6 mt -55.73 -45.27 78.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.157 1.783 . . . . 0.0 115.619 171.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 34.83 65.85 1.58 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 127.051 2.14 . . . . 0.0 115.3 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.64 33.91 0.09 OUTLIER 'Trans proline' 0 CA--C 1.557 1.659 1 C-N-CA 125.814 4.342 . . . . 0.0 118.452 -175.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 10.93 85.36 Favored Glycine 0 CA--C 1.539 1.587 0 O-C-N 119.762 -1.836 . . . . 0.0 114.351 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.22 164.0 4.53 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.304 2.241 . . . . 0.0 115.337 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.07 139.49 44.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.79 2.036 . . . . 0.0 111.818 164.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -104.56 135.37 46.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.276 1.03 . . . . 0.0 112.376 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -118.71 135.17 54.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.498 2.319 . . . . 0.0 109.241 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -112.37 129.23 56.38 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 122.315 1.055 . . . . 0.0 112.146 -174.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.74 150.99 51.49 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 129.75 3.22 . . . . 0.0 108.392 -171.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.6 p -118.62 126.93 53.03 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 126.777 2.031 . . . . 0.0 113.977 -169.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.358 0.8 OUTLIER 69.61 43.82 0.95 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 123.515 1.626 . . . . 0.0 114.749 147.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -70.15 -2.15 12.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 129.292 3.037 . . . . 0.0 115.794 175.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.67 25.26 4.49 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 116.718 1.447 . . . . 0.0 116.718 -151.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.89 -23.34 67.31 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.894 1.847 . . . . 0.0 113.555 -177.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 p -68.83 -16.45 63.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.504 1.922 . . . . 0.0 114.385 170.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -153.28 51.11 0.72 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.791 2.036 . . . . 0.0 110.587 -175.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -38.33 118.37 0.71 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.682 1.993 . . . . 0.0 114.039 -165.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.1 mmtm -128.06 165.54 20.14 Favored 'General case' 0 N--CA 1.479 0.995 1 C-N-CA 132.387 4.275 . . . . 0.0 110.702 10.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.9 m -135.26 106.68 6.83 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 164.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -87.5 136.85 32.78 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 102.654 -3.091 . . . . 0.0 102.654 156.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.1 t -124.1 130.03 73.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 123.197 1.475 . . . . 0.0 109.302 -157.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.5 mmm -118.29 135.34 54.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 113.52 -1.673 . . . . 0.0 108.799 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.5 m -125.19 135.46 52.62 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.508 0.723 . . . . 0.0 110.197 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.6 m -117.86 135.92 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.251 1.021 . . . . 0.0 111.992 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.5 t -104.2 126.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 164.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.7 p -151.66 149.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.693 1.197 . . . . 0.0 110.347 -178.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 55.8 -69.85 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.32 2.248 . . . . 0.0 114.112 -168.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.02 21.88 0.08 OUTLIER Glycine 0 CA--C 1.537 1.451 0 C-N-CA 128.396 2.903 . . . . 0.0 111.794 173.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -128.55 162.43 27.27 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.441 2.296 . . . . 0.0 109.878 -167.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -132.81 133.66 43.66 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.95 1.3 . . . . 0.0 111.626 -173.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -135.11 141.5 46.03 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.608 1.163 . . . . 0.0 110.741 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -118.16 135.04 54.48 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.337 1.855 . . . . 0.0 109.976 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.82 132.7 6.55 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.625 1.107 . . . . 0.0 112.556 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -128.03 104.65 7.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.748 0.785 . . . . 0.0 111.719 -164.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.96 140.56 11.68 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 125.49 1.519 . . . . 0.0 115.161 -163.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -47.37 -27.68 1.74 Allowed 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 116.074 1.879 . . . . 0.0 116.074 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -154.97 174.75 14.72 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 126.639 1.976 . . . . 0.0 109.498 162.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -53.11 -31.78 43.89 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 127.393 2.277 . . . . 0.0 115.982 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -13.9 7.78 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 121.226 1.83 . . . . 0.0 115.127 167.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.35 -50.79 2.72 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.209 2.204 . . . . 0.0 110.264 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -52.56 63.19 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.377 -1.452 . . . . 0.0 112.962 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -55.14 -48.41 73.73 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-O 117.23 -1.367 . . . . 0.0 109.444 169.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.06 72.37 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 120.561 1.528 . . . . 0.0 113.675 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -55.31 -60.95 2.69 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.574 1.149 . . . . 0.0 112.178 172.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -50.87 68.51 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.252 1.021 . . . . 0.0 112.207 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.67 -66.98 0.29 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 126.517 1.927 . . . . 0.0 111.904 171.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -55.45 -38.49 69.12 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.257 0.935 . . . . 0.0 112.942 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 t -55.33 -59.72 4.41 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.872 0.869 . . . . 0.0 113.167 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.14 -56.39 20.43 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.122 1.369 . . . . 0.0 112.672 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -43.54 -61.49 1.37 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 111.458 172.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.24 -49.25 67.22 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.809 0.731 . . . . 0.0 111.165 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 35.9 m -55.29 -73.38 0.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 173.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.273 34.0 m -55.51 -44.39 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 7.6 m-30 -56.38 -48.88 75.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 171.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.86 -37.06 68.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 120.212 1.369 . . . . 0.0 113.696 169.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.39 -39.62 91.36 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.582 1.153 . . . . 0.0 111.655 168.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.295 20.4 m-70 98.08 44.72 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 131.062 3.745 . . . . 0.0 112.538 177.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.25 1.094 0 C-N-CA 127.187 2.195 . . . . 0.0 110.87 178.68 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo . . . . . 0 N--CA 1.489 1.241 0 CA-C-O 119.028 -0.488 . . . . 0.0 112.816 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.1 p -140.92 -58.63 0.51 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.649 1.18 . . . . 0.0 112.963 -173.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -65.44 -16.61 63.16 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.997 1.284 . . . . 0.0 113.827 168.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -132.52 95.13 3.55 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.556 2.342 . . . . 0.0 108.369 166.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -153.4 132.3 6.85 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.522 1.529 . . . . 0.0 109.124 -175.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.49 -36.11 27.61 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 121.474 1.449 . . . . 0.0 113.54 -174.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 78.5 t -53.87 -51.76 41.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.03 -49.13 72.33 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -177.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.64 -58.18 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.218 1.007 . . . . 0.0 111.371 174.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.06 -46.36 75.37 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.453 1.101 . . . . 0.0 111.635 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -55.56 -57.29 12.54 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.271 1.828 . . . . 0.0 112.427 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -55.85 -53.16 60.08 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.708 1.603 . . . . 0.0 113.174 175.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.46 -34.97 64.98 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.069 1.348 . . . . 0.0 113.488 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 35.8 54.11 2.22 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 127.161 2.184 . . . . 0.0 115.245 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -73.21 58.53 3.6 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 124.71 3.607 . . . . 0.0 115.227 -167.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.42 17.89 78.0 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.513 1.53 . . . . 0.0 114.84 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -81.62 174.1 11.72 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -172.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -134.97 143.06 46.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 127.127 2.171 . . . . 0.0 110.309 157.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -104.32 129.64 52.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 124.664 1.228 . . . . 0.0 109.584 172.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.72 135.18 51.71 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 127.69 2.396 . . . . 0.0 108.482 177.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -109.77 125.63 52.9 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 123.144 1.45 . . . . 0.0 111.701 -176.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 mp -135.09 157.09 47.82 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 131.319 3.847 . . . . 0.0 105.826 -173.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 m -149.66 102.09 3.13 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 119.317 -2.114 . . . . 0.0 110.144 169.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.45 -18.12 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 120.385 3.476 . . . . 0.0 120.385 -174.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -72.45 34.56 0.07 Allowed 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 116.064 1.875 . . . . 0.0 116.064 -169.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 176.43 27.42 0.03 OUTLIER Glycine 0 N--CA 1.472 1.076 0 N-CA-C 118.319 2.088 . . . . 0.0 118.319 -173.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -60.55 -34.95 74.9 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.185 1.993 . . . . 0.0 114.333 -173.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.9 t -72.0 -6.45 42.29 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.884 1.274 . . . . 0.0 113.594 176.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -143.76 52.37 1.32 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.197 2.199 . . . . 0.0 109.551 175.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.0 141.18 6.19 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.24 1.816 . . . . 0.0 115.512 -161.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -135.82 137.24 41.35 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 129.888 3.275 . . . . 0.0 110.819 4.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.7 m -104.76 125.79 51.19 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 122.453 1.12 . . . . 0.0 111.116 175.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -104.35 133.45 49.23 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 104.604 -2.369 . . . . 0.0 104.604 174.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -118.65 117.74 55.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 123.046 1.403 . . . . 0.0 110.561 -168.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.2 mmm -105.33 126.06 51.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.733 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.7 m -116.71 135.5 53.72 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 123.652 0.781 . . . . 0.0 110.125 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 m -119.48 135.91 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.954 0.902 . . . . 0.0 111.702 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 87.8 t -104.11 127.79 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 160.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.1 p -148.85 146.93 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.825 1.65 . . . . 0.0 109.321 -174.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.6 t70 59.07 -67.22 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.944 2.098 . . . . 0.0 114.668 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 19.47 0.07 OUTLIER Glycine 0 CA--C 1.541 1.719 0 C-N-CA 128.528 2.966 . . . . 0.0 112.798 169.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -135.12 165.04 26.3 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.721 2.408 . . . . 0.0 111.667 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -133.92 137.39 44.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.538 1.135 . . . . 0.0 112.779 -167.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -135.13 157.48 46.82 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.428 1.491 . . . . 0.0 111.812 -175.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -132.83 133.83 43.87 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.557 1.943 . . . . 0.0 109.268 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -131.4 113.54 1.38 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 125.036 1.303 . . . . 0.0 112.089 -175.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.5 p -104.99 108.96 20.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.289 1.035 . . . . 0.0 112.122 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.65 143.49 15.05 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.927 1.727 . . . . 0.0 114.466 -173.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -17.85 1.47 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 177.199 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -161.5 179.51 8.17 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.499 1.92 . . . . 0.0 110.308 153.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -45.45 -40.45 8.3 Favored 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.357 1.863 . . . . 0.0 115.766 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.01 -16.96 5.62 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 174.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -118.33 -44.24 2.68 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.886 2.074 . . . . 0.0 111.378 176.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.46 -53.26 58.53 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.582 -1.324 . . . . 0.0 112.77 175.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.2 ttmt -55.24 -46.25 76.04 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-O 116.53 -1.7 . . . . 0.0 110.967 166.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.05 75.06 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 121.972 2.169 . . . . 0.0 112.578 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -55.48 -60.25 3.69 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.522 1.929 . . . . 0.0 112.163 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.24 -50.66 68.89 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.428 1.091 . . . . 0.0 112.322 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.5 -59.64 3.57 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.239 1.816 . . . . 0.0 111.618 170.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -48.35 72.77 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 120.104 1.32 . . . . 0.0 110.691 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -55.36 -60.33 3.55 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 173.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.37 -61.55 2.26 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 126.493 1.917 . . . . 0.0 112.307 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.7 tp -53.29 -53.26 53.46 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.647 2.379 . . . . 0.0 111.922 -177.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.33 74.42 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.052 0.842 . . . . 0.0 112.802 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 95.6 m -55.28 -62.55 1.6 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.6 0.76 . . . . 0.0 112.984 175.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 m -55.58 -46.29 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.95 -47.45 77.58 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.83 -38.93 70.69 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.719 1.208 . . . . 0.0 114.248 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -39.19 89.88 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.993 1.317 . . . . 0.0 111.803 167.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.313 25.2 m-70 99.77 39.79 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 131.178 3.791 . . . . 0.0 113.297 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.7 mt . . . . . 0 N--CA 1.481 1.077 0 C-N-CA 126.93 2.092 . . . . 0.0 113.168 173.718 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo . . . . . 0 CA--C 1.541 0.838 0 N-CA-C 113.176 0.414 . . . . 0.0 113.176 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.2 m 47.73 30.94 1.98 Allowed 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 166.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 143.22 -25.35 2.2 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 124.95 1.262 . . . . 0.0 113.951 -177.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -134.78 120.83 19.88 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.057 1.343 . . . . 0.0 111.614 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -58.99 145.1 81.02 Favored Pre-proline 0 CA--C 1.553 1.077 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 156.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -59.12 -33.54 98.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.599 2.199 . . . . 0.0 115.12 -178.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.6 t -55.18 -44.77 76.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 CA-C-N 118.85 0.75 . . . . 0.0 110.548 168.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.32 -42.64 74.02 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.854 -1.154 . . . . 0.0 113.019 177.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.6 mt -60.22 -57.39 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.648 1.179 . . . . 0.0 110.684 173.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.479 HD12 ' HH ' ' A' ' 19' ' ' TYR 0.315 0.0 OUTLIER -55.84 -38.9 70.68 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 115.645 1.721 . . . . 0.0 115.645 176.291 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -56.13 -52.86 62.83 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 124.848 1.259 . . . . 0.0 111.559 171.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.26 -65.62 0.55 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.705 1.602 . . . . 0.0 113.175 173.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.8 mt -55.57 -43.41 75.88 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.636 1.574 . . . . 0.0 115.234 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.263 7.7 ptm85 30.24 66.89 0.79 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 128.299 2.64 . . . . 0.0 115.246 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -61.02 20.17 0.04 OUTLIER 'Trans proline' 0 CA--C 1.552 1.392 1 C-N-CA 125.777 4.318 . . . . 0.0 118.348 -175.284 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.19 30.36 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.123 1.345 . . . . 0.0 113.698 -175.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 pp -88.7 159.67 17.71 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -176.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.46 138.42 43.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.212 1.805 . . . . 0.0 112.493 -179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.479 ' HH ' HD12 ' A' ' 10' ' ' LEU . 13.5 m-85 -104.67 135.13 46.64 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.431 1.11 . . . . 0.0 112.85 -171.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -105.28 135.32 46.86 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.018 2.527 . . . . 0.0 108.843 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -108.35 121.11 44.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.114 0.959 . . . . 0.0 110.958 175.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.6 155.97 43.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 129.453 3.101 . . . . 0.0 107.123 -175.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.7 t -114.93 161.19 18.62 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 120.451 -1.405 . . . . 0.0 110.857 160.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.301 19.7 mm-40 95.7 82.53 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.163 2.185 . . . . 0.0 115.72 164.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.7 t -128.74 53.07 1.88 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.809 1.644 . . . . 0.0 110.285 161.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -162.67 -158.89 9.94 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 125.087 1.327 . . . . 0.0 113.083 -170.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -73.38 170.01 15.96 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.148 -2.384 . . . . 0.0 114.012 4.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.2 t -144.48 -151.28 0.36 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.561 1.944 . . . . 0.0 108.926 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -52.59 -18.82 1.92 Allowed 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.735 1.614 . . . . 0.0 114.03 163.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -148.98 173.98 12.77 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.583 2.353 . . . . 0.0 110.733 173.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.4 tppt? -61.75 152.35 31.47 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.821 1.248 . . . . 0.0 111.066 164.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.6 m -117.24 125.14 50.66 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.215 1.406 . . . . 0.0 110.599 169.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -104.71 135.74 45.54 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 105.915 -1.884 . . . . 0.0 105.915 170.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.3 t -112.84 117.5 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 122.038 0.923 . . . . 0.0 109.208 -169.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 78.9 mmm -104.77 135.04 46.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 173.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.2 m -132.81 135.47 45.69 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 122.47 0.308 . . . . 0.0 111.055 -176.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.11 135.51 60.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.303 1.041 . . . . 0.0 112.191 -173.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.6 t -104.47 120.11 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 167.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 78.2 t -125.04 -45.44 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -157.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -148.27 29.98 0.86 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 122.669 1.223 . . . . 0.0 111.066 -162.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.94 -12.71 22.47 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 120.532 -1.355 . . . . 0.0 112.963 -162.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -109.96 161.78 15.16 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 126.688 1.995 . . . . 0.0 111.735 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -134.85 137.96 43.75 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.039 1.736 . . . . 0.0 111.389 -162.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -134.97 149.94 50.29 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.373 1.469 . . . . 0.0 111.088 -175.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -132.9 135.04 45.34 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.274 1.43 . . . . 0.0 110.399 -174.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.83 117.41 1.75 Allowed Glycine 0 CA--C 1.523 0.557 0 C-N-CA 125.238 1.399 . . . . 0.0 112.707 -167.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 p -106.64 104.73 14.49 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.736 1.214 . . . . 0.0 112.26 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 147.73 19.33 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.633 1.587 . . . . 0.0 114.795 -173.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -44.24 -39.32 4.37 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -155.2 177.42 11.36 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.777 1.631 . . . . 0.0 110.333 165.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -45.23 -41.39 8.37 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 127.422 2.289 . . . . 0.0 116.159 -174.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 -13.87 1.74 Allowed 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.5 tp -125.98 -42.71 1.87 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.439 2.295 . . . . 0.0 111.505 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.72 40.49 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.443 -1.411 . . . . 0.0 112.333 172.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -55.41 -39.77 70.62 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 117.419 -1.277 . . . . 0.0 111.932 168.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.39 -54.83 38.82 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.576 1.535 . . . . 0.0 111.667 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -54.99 -52.79 62.02 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.638 1.975 . . . . 0.0 113.661 171.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -52.62 63.11 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.622 0.769 . . . . 0.0 112.126 177.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.18 -53.65 47.51 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 125.854 1.662 . . . . 0.0 112.202 171.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -52.49 -50.4 62.81 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.634 1.574 . . . . 0.0 111.876 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.8 t -55.3 -56.45 19.91 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 113.034 171.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -61.45 2.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.771 1.229 . . . . 0.0 112.718 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.401 ' HG ' ' CE2' ' A' ' 67' ' ' PHE . 0.4 OUTLIER -46.23 -57.78 4.25 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 128.566 2.746 . . . . 0.0 111.5 176.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.89 -49.88 70.14 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.528 0.604 . . . . 0.0 111.103 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 50.2 m -55.24 -73.97 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 173.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.288 18.3 m -55.72 -44.62 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -175.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 6.6 m-30 -60.06 -44.54 94.65 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.652 -1.28 . . . . 0.0 114.149 172.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.83 -37.6 68.9 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.384 1.447 . . . . 0.0 114.439 168.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.49 -40.06 89.96 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.851 1.26 . . . . 0.0 111.594 167.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.303 23.6 m-70 100.53 42.99 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 130.923 3.689 . . . . 0.0 112.784 176.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.7 tp . . . . . 0 C--O 1.249 1.056 0 C-N-CA 126.157 1.783 . . . . 0.0 111.374 172.788 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo . . . . . 0 CA--C 1.539 0.764 0 N-CA-C 113.63 0.589 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 t 55.52 -165.69 0.11 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.811 1.644 . . . . 0.0 113.545 -176.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -171.49 -166.32 30.07 Favored Glycine 0 CA--C 1.54 1.626 0 N-CA-C 117.214 1.646 . . . . 0.0 117.214 -172.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -143.83 3.27 1.24 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 116.84 2.163 . . . . 0.0 116.84 13.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -56.34 101.63 0.27 Allowed Pre-proline 0 N--CA 1.48 1.062 0 CA-C-N 120.424 1.465 . . . . 0.0 110.7 174.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -78.94 -45.4 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.441 0 CA-C-N 121.004 1.394 . . . . 0.0 114.942 -141.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 90.0 t -55.04 -52.9 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 173.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -55.45 -54.77 39.68 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 127.154 2.181 . . . . 0.0 115.558 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.276 1.7 pt -59.95 -50.38 80.34 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-O 118.115 -0.945 . . . . 0.0 113.085 172.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.307 0.0 OUTLIER -55.52 -46.24 77.05 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.462 1.483 . . . . 0.0 113.521 178.692 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -46.96 -63.07 1.13 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.247 2.219 . . . . 0.0 111.809 168.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -56.28 -47.02 79.45 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 176.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.5 mt -55.67 -29.16 58.86 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.909 1.283 . . . . 0.0 114.342 171.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 35.36 60.41 2.62 Favored Pre-proline 0 N--CA 1.486 1.362 0 C-N-CA 126.782 2.033 . . . . 0.0 116.238 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -59.42 21.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.56 1.786 0 C-N-CA 125.244 3.963 . . . . 0.0 119.58 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.23 24.72 76.69 Favored Glycine 0 CA--C 1.536 1.391 0 O-C-N 119.856 -1.777 . . . . 0.0 112.775 -167.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.42 171.96 7.89 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.918 2.087 . . . . 0.0 115.032 -172.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.35 135.25 40.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.091 1.357 . . . . 0.0 111.942 158.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -104.68 135.63 45.71 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.235 1.414 . . . . 0.0 110.549 173.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -130.31 135.16 47.78 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.418 1.487 . . . . 0.0 109.906 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -107.98 128.56 54.76 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.578 1.18 . . . . 0.0 112.214 -168.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.8 151.49 52.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 129.839 3.256 . . . . 0.0 106.702 -172.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p -133.07 104.19 6.4 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 119.933 -1.73 . . . . 0.0 110.127 161.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -159.51 -12.07 0.06 Allowed 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 120.098 3.37 . . . . 0.0 120.098 -171.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.1 t -76.13 29.61 0.12 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 121.183 1.811 . . . . 0.0 113.813 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -171.22 13.64 0.05 OUTLIER Glycine 0 N--CA 1.469 0.845 0 C-N-CA 124.872 1.225 . . . . 0.0 115.253 -174.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -51.32 -40.27 58.69 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.905 1.446 . . . . 0.0 114.905 -157.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.7 m -81.86 -9.53 59.58 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -175.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -152.25 -26.59 0.17 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 117.293 2.331 . . . . 0.0 117.293 -165.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -144.05 -9.58 0.68 Allowed 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 -172.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.7 tptt 38.59 84.87 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.47 2.308 . . . . 0.0 113.327 -176.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.7 m -104.34 135.74 45.23 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.167 0.987 . . . . 0.0 109.526 -166.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -96.41 122.11 38.95 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 -164.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.4 t -109.89 124.24 66.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.021 -1.445 . . . . 0.0 109.89 -169.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 63.1 mmm -104.86 124.36 49.31 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -111.38 134.02 53.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.513 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.64 135.58 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.469 0.708 . . . . 0.0 111.571 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -104.47 119.79 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 166.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.7 m -133.65 -3.03 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 -160.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -155.43 -20.11 0.11 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 -174.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.31 -18.33 28.06 Favored Glycine 0 CA--C 1.538 1.48 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -142.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -105.0 162.17 13.58 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.701 1.6 . . . . 0.0 110.841 170.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -133.68 140.05 46.81 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.254 1.822 . . . . 0.0 110.925 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.03 159.56 41.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.103 1.361 . . . . 0.0 111.532 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -135.6 134.66 39.54 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.361 1.864 . . . . 0.0 109.411 176.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.1 120.71 2.83 Favored Glycine 0 CA--C 1.523 0.551 0 C-N-CA 125.158 1.361 . . . . 0.0 111.338 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.4 p -105.01 110.47 22.88 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.648 1.179 . . . . 0.0 111.708 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.47 155.75 22.35 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.867 1.698 . . . . 0.0 114.465 -168.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -55.06 -38.74 68.41 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.801 -0.823 . . . . 0.0 113.148 174.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -151.17 -177.44 6.04 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.794 1.638 . . . . 0.0 109.193 159.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.5 mtmm -44.22 -35.04 2.08 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 127.683 2.393 . . . . 0.0 115.082 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.2 pttt -46.34 -29.91 1.87 Allowed 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.5 tp -121.3 -40.7 2.56 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.193 2.197 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.55 -52.03 65.08 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.904 1.282 . . . . 0.0 112.664 173.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -55.38 -47.93 75.07 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 117.398 -1.286 . . . . 0.0 110.866 166.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.8 73.7 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 120.471 1.487 . . . . 0.0 112.686 -176.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.4 mmm-85 -55.03 -59.77 4.3 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.885 2.874 . . . . 0.0 113.305 169.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -49.42 72.57 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.594 0.712 . . . . 0.0 112.506 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.98 -51.49 66.04 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 126.646 1.978 . . . . 0.0 112.111 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -54.94 -47.6 74.25 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.409 1.484 . . . . 0.0 111.904 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.33 -54.97 36.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.577 1.151 . . . . 0.0 112.774 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.1 -57.94 9.71 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.98 -55.06 13.05 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 128.371 2.668 . . . . 0.0 111.61 176.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.11 68.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.504 0.593 . . . . 0.0 110.92 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 27.1 m -55.47 -74.67 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 172.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.1 m -55.56 -37.28 45.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.26 4.8 m-30 -68.47 -33.61 74.48 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 171.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -55.51 -35.26 65.41 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.152 -1.592 . . . . 0.0 113.156 159.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.5 mt -65.44 -47.34 76.53 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 118.248 -0.882 . . . . 0.0 112.429 169.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -158.09 138.38 12.58 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 151.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.6 tt . . . . . 0 C--O 1.251 1.155 0 C-N-CA 128.674 2.789 . . . . 0.0 114.712 -168.539 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo . . . . . 0 N--CA 1.486 1.055 0 N-CA-C 113.863 0.678 . . . . 0.0 113.863 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.4 m -54.5 161.87 1.31 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.551 1.941 . . . . 0.0 114.297 176.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 111.55 21.29 6.55 Favored Glycine 0 CA--C 1.538 1.481 0 N-CA-C 115.453 0.941 . . . . 0.0 115.453 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 mtmm -137.85 -173.41 3.5 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.323 1.849 . . . . 0.0 110.418 -178.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -46.5 133.4 7.88 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.399 1.08 . . . . 0.0 111.417 172.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.14 -35.69 8.37 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 121.047 1.165 . . . . 0.0 113.786 -168.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 97.0 t -54.99 -53.24 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 171.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.55 -55.47 31.59 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.271 7.3 pt -58.42 -47.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 120.735 1.607 . . . . 0.0 114.399 174.603 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.275 0.0 OUTLIER -55.58 -46.65 77.22 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 174.676 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -55.2 -54.69 40.16 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.464 1.905 . . . . 0.0 112.324 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -55.4 -61.1 2.56 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.548 1.939 . . . . 0.0 113.259 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.3 mt -55.62 -34.91 65.32 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 175.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 36.76 58.57 3.64 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 127.127 2.171 . . . . 0.0 114.598 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.62 65.61 1.2 Allowed 'Trans proline' 0 CA--C 1.551 1.366 0 C-N-CA 124.52 3.48 . . . . 0.0 115.253 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.58 29.48 75.26 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.787 1.661 . . . . 0.0 114.835 172.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.3 pp -105.21 166.27 10.52 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 -163.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.31 145.63 47.67 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.733 2.013 . . . . 0.0 111.886 166.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -104.56 128.92 52.66 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.686 0.795 . . . . 0.0 110.471 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -104.89 134.34 48.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.227 1.811 . . . . 0.0 109.258 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.43 ' CE1' ' HE3' ' A' ' 51' ' ' LYS . 62.9 t80 -113.17 126.11 55.08 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.784 1.278 . . . . 0.0 110.969 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.93 154.92 47.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 130.065 3.346 . . . . 0.0 106.024 -173.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.5 t -133.94 116.5 15.65 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 119.577 -1.952 . . . . 0.0 110.133 164.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.62 -50.86 0.09 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -143.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -79.82 179.86 7.32 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.921 1.688 . . . . 0.0 112.382 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.07 -32.15 4.27 Favored Glycine 0 N--CA 1.476 1.328 0 N-CA-C 117.964 1.946 . . . . 0.0 117.964 148.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.23 -3.71 0.29 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.512 1.925 . . . . 0.0 115.959 -169.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.0 p -41.72 -31.6 0.31 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.101 1.36 . . . . 0.0 114.565 151.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -150.67 -47.06 0.12 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.948 1.699 . . . . 0.0 112.418 176.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -167.34 154.1 8.35 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.409 1.884 . . . . 0.0 110.589 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -46.32 133.53 9.53 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.627 1.171 . . . . 0.0 113.114 -176.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.3 m -123.04 139.48 54.04 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 127.054 2.141 . . . . 0.0 111.64 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -99.07 134.28 42.13 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 -170.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.4 t -112.99 127.21 70.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 123.287 1.518 . . . . 0.0 110.22 -170.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.75 135.12 46.72 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.961 -1.472 . . . . 0.0 107.571 171.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -122.67 135.31 54.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 122.739 0.416 . . . . 0.0 110.582 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.88 135.78 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.555 -0.716 . . . . 0.0 111.529 172.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.8 t -101.09 122.07 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 160.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.97 142.75 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 127.015 2.126 . . . . 0.0 108.881 -167.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.8 t70 58.32 -67.04 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.428 1.891 . . . . 0.0 114.172 -174.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -170.11 17.97 0.07 OUTLIER Glycine 0 CA--C 1.541 1.706 0 C-N-CA 128.539 2.971 . . . . 0.0 112.827 169.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -134.96 165.81 24.48 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.767 2.427 . . . . 0.0 111.73 -168.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -134.86 128.61 32.98 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.467 1.107 . . . . 0.0 112.222 -162.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.37 136.59 43.48 Favored 'General case' 0 C--O 1.206 -1.218 0 C-N-CA 124.923 1.289 . . . . 0.0 111.956 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -104.44 134.51 47.52 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 126.719 2.008 . . . . 0.0 109.85 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.69 112.67 1.16 Allowed Glycine 0 CA--C 1.52 0.367 0 C-N-CA 124.796 1.189 . . . . 0.0 112.202 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 p -104.8 117.18 33.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.671 0.788 . . . . 0.0 111.867 -172.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.52 146.49 18.5 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 125.158 1.361 . . . . 0.0 115.489 -166.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.42 -36.04 6.13 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 168.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -157.52 178.18 10.58 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.792 2.037 . . . . 0.0 109.066 162.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.43 ' HE3' ' CE1' ' A' ' 21' ' ' PHE . 82.0 mttt -46.44 -36.4 6.54 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 126.676 1.99 . . . . 0.0 115.162 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -16.14 2.42 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.249 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.3 tp -123.31 -43.29 2.2 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.7 2.0 . . . . 0.0 110.724 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.5 -52.43 63.7 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.554 -1.341 . . . . 0.0 112.279 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 5.4 ttmt -55.41 -47.28 76.16 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 117.529 -1.224 . . . . 0.0 110.677 169.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.49 -47.68 75.8 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 120.273 1.397 . . . . 0.0 112.615 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -55.48 -59.66 4.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.738 2.015 . . . . 0.0 112.03 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.35 -49.84 71.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.39 1.076 . . . . 0.0 112.092 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.23 -58.62 6.43 Favored 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 126.344 1.858 . . . . 0.0 112.406 173.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -55.31 -44.86 76.17 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.442 1.474 . . . . 0.0 111.689 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.6 m -55.26 -55.31 32.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.87 0.868 . . . . 0.0 112.505 173.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.24 -56.24 22.26 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.739 1.215 . . . . 0.0 112.329 174.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.41 -56.87 6.08 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 128.047 2.539 . . . . 0.0 111.183 176.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.15 -52.69 60.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.298 0.499 . . . . 0.0 110.762 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -71.2 0.09 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 175.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.289 24.7 m -55.26 -51.32 56.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 O-C-N 121.058 -1.026 . . . . 0.0 112.587 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.9 m-30 -55.79 -33.93 64.84 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 121.366 1.894 . . . . 0.0 114.777 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -55.72 -38.12 69.32 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 162.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.9 mt -57.23 -48.95 77.54 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 162.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -165.11 175.13 9.64 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 -153.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.8 mt . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.916 1.686 . . . . 0.0 111.323 159.237 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 N--CA 1.489 1.222 0 N-CA-C 111.976 -0.048 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.1 t -154.98 142.76 19.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.672 1.189 . . . . 0.0 111.48 176.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 166.56 -60.17 0.23 Allowed Glycine 0 CA--C 1.528 0.896 0 O-C-N 119.269 -2.144 . . . . 0.0 114.075 -7.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.9 tmtt? -57.74 -44.87 86.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.141 0.976 . . . . 0.0 113.003 178.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -56.03 -49.69 91.61 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 116.885 -1.531 . . . . 0.0 114.973 -171.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.7 -39.71 25.57 Favored 'Trans proline' 0 C--N 1.35 0.612 0 CA-C-N 122.383 1.887 . . . . 0.0 113.825 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.7 t -54.24 -50.93 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -55.71 28.44 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.09 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.0 pt -55.58 -49.2 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.821 1.191 . . . . 0.0 113.671 172.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -51.26 65.81 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.51 1.05 . . . . 0.0 112.047 177.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -55.63 -54.01 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.207 1.803 . . . . 0.0 112.72 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -59.99 -45.03 94.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -39.56 71.33 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.963 1.305 . . . . 0.0 113.359 171.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 30.85 61.11 1.05 Allowed Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 127.826 2.45 . . . . 0.0 116.241 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -53.63 -38.83 84.49 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.513 2.142 . . . . 0.0 114.918 -174.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.36 33.92 0.12 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.411 1.481 . . . . 0.0 112.258 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -77.61 151.58 34.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 117.046 2.239 . . . . 0.0 117.046 -154.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 135.8 40.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.203 2.201 . . . . 0.0 112.606 157.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.651 ' CD2' ' HE3' ' A' ' 55' ' ' LYS . 65.3 m-85 -104.86 135.58 45.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.822 1.249 . . . . 0.0 112.913 -177.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -108.12 135.73 48.98 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 128.664 2.785 . . . . 0.0 110.91 173.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -104.97 126.57 52.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.558 1.143 . . . . 0.0 111.452 171.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.7 mp -135.05 144.28 47.18 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 129.475 3.11 . . . . 0.0 106.903 -173.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p -74.54 176.12 7.16 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 119.31 -2.119 . . . . 0.0 111.293 149.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.308 8.2 tp10 134.51 -5.49 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 119.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 t -61.11 153.67 25.07 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.081 -1.012 . . . . 0.0 110.879 164.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -153.12 163.01 30.41 Favored Glycine 0 CA--C 1.532 1.123 0 O-C-N 121.431 -0.793 . . . . 0.0 112.959 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -136.09 44.02 2.48 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.772 1.229 . . . . 0.0 111.102 -152.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.3 p 64.34 -31.76 0.12 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 129.254 3.022 . . . . 0.0 116.731 -175.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -148.25 12.98 0.96 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.512 1.525 . . . . 0.0 112.97 178.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -146.91 171.5 15.13 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.303 1.441 . . . . 0.0 111.252 176.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -130.31 147.71 52.05 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.109 1.363 . . . . 0.0 112.541 -175.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.56 146.8 50.4 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 128.05 2.54 . . . . 0.0 111.568 -171.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -104.14 135.01 46.43 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 104.146 -2.539 . . . . 0.0 104.146 -179.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.7 t -112.98 116.55 52.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 123.103 1.43 . . . . 0.0 109.063 -161.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.8 mmt -105.14 122.94 46.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.478 -1.237 . . . . 0.0 107.859 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -128.5 135.24 49.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -172.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.2 t -135.03 135.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 120.839 -1.163 . . . . 0.0 109.724 -163.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.7 t -104.1 104.73 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 103.061 -2.941 . . . . 0.0 103.061 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.8 p -100.84 -12.39 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -152.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -167.72 -37.38 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.258 2.223 . . . . 0.0 111.643 -158.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 150.78 -25.06 1.04 Allowed Glycine 0 CA--C 1.538 1.515 0 C-N-CA 125.872 1.701 . . . . 0.0 110.72 -161.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.85 163.0 13.07 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 125.26 1.424 . . . . 0.0 110.372 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.81 138.67 53.85 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.71 1.604 . . . . 0.0 112.079 -168.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -135.11 157.67 46.34 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.166 1.786 . . . . 0.0 111.844 -172.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -139.54 133.48 30.86 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.442 1.497 . . . . 0.0 110.384 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.96 119.58 2.17 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.471 1.51 . . . . 0.0 112.305 -173.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.2 p -105.24 104.96 14.79 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.409 1.084 . . . . 0.0 112.413 -171.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.87 138.03 9.6 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 125.115 1.34 . . . . 0.0 115.766 -176.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -57.66 -12.92 3.24 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -155.5 177.85 10.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.527 1.131 . . . . 0.0 111.231 155.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -49.75 -51.76 36.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 124.834 1.253 . . . . 0.0 113.818 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -6.76 0.44 Allowed 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 177.299 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.3 tp -115.26 -44.74 2.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.712 1.605 . . . . 0.0 110.308 171.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.56 -59.2 5.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.876 1.271 . . . . 0.0 113.086 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.651 ' HE3' ' CD2' ' A' ' 19' ' ' TYR . 18.8 mmtm -55.45 -37.81 68.21 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 115.288 -2.291 . . . . 0.0 112.581 164.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.72 -54.67 41.43 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 123.355 2.798 . . . . 0.0 111.492 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.33 -55.43 31.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 129.089 2.956 . . . . 0.0 113.749 170.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.41 -56.62 17.99 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 111.462 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -44.97 -62.04 1.39 Allowed 'General case' 0 C--O 1.215 -0.749 0 C-N-CA 124.084 0.953 . . . . 0.0 113.161 166.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -47.53 -53.19 15.07 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.413 1.485 . . . . 0.0 112.015 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 25.1 p -55.4 -57.57 11.33 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 173.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.32 -64.25 0.9 Allowed 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 126.635 1.974 . . . . 0.0 112.014 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.9 tp -50.43 -54.45 21.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.677 2.791 . . . . 0.0 111.988 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.17 -49.39 71.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.504 0.593 . . . . 0.0 112.388 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.3 m -55.43 -60.99 2.64 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 175.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 4.8 m -55.26 -47.56 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.275 0.943 . . . . 0.0 112.707 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.85 -47.05 77.97 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -55.49 -39.72 70.79 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.732 1.213 . . . . 0.0 112.541 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -63.15 1.34 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.813 1.245 . . . . 0.0 110.374 166.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -170.79 164.51 7.94 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.163 1.785 . . . . 0.0 113.466 155.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.146 0 C-N-CA 126.958 2.103 . . . . 0.0 109.842 170.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo . . . . . 0 C--O 1.235 0.341 0 N-CA-C 114.862 1.062 . . . . 0.0 114.862 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.559 HG13 ' HG2' ' A' ' 55' ' ' LYS . 71.8 t -55.09 -51.53 53.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.33 -44.26 75.69 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.072 1.349 . . . . 0.0 114.386 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mt -58.23 -57.76 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 123.829 0.851 . . . . 0.0 112.148 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -55.32 -38.54 68.84 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.601 0.715 . . . . 0.0 112.304 178.947 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -55.08 -61.31 2.4 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.152 1.781 . . . . 0.0 111.928 168.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -55.57 -56.47 19.99 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.05 -1.031 . . . . 0.0 113.179 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.6 mt -55.93 -29.16 59.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 117.504 2.409 . . . . 0.0 117.504 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.325 0.0 OUTLIER -9.21 75.92 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.757 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 -167.695 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -58.04 -34.55 98.55 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 122.022 1.815 . . . . 0.0 116.196 -165.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 177.55 30.12 0.04 OUTLIER Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.228 1.394 . . . . 0.0 112.123 172.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -96.51 164.14 12.74 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -161.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.12 141.28 45.96 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.634 1.574 . . . . 0.0 112.535 173.638 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -104.55 135.23 46.34 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.623 1.169 . . . . 0.0 111.764 -177.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -104.82 135.25 46.53 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.106 1.362 . . . . 0.0 109.685 164.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -104.43 119.94 40.1 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.103 0.954 . . . . 0.0 109.016 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 136.02 54.57 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 128.846 2.859 . . . . 0.0 106.57 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 C--N 1.318 -0.766 0 O-C-N 119.463 -2.023 . . . . 0.0 109.756 154.723 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 . . . . . 0 N--CA 1.445 -0.707 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.92 130.09 71.19 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 122.711 1.243 . . . . 0.0 109.875 -167.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 5.4 mmt -115.09 123.87 50.11 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.532 0.733 . . . . 0.0 110.333 177.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.88 136.58 44.11 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.931 0.892 . . . . 0.0 110.443 172.222 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.4 m -121.98 135.87 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.114 0.566 . . . . 0.0 112.397 167.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.9 t -104.47 128.54 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 161.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.436 HG13 ' H ' ' A' ' 40' ' ' ASP 0.305 7.7 p -126.74 -110.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 124.626 1.17 . . . . 0.0 111.508 -179.373 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.436 ' H ' HG13 ' A' ' 39' ' ' VAL . 25.4 t0 -81.14 45.22 0.82 Allowed 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 121.189 1.813 . . . . 0.0 114.025 -168.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.4 13.99 80.89 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.935 -1.103 . . . . 0.0 112.07 -166.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -119.09 153.1 35.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 127.013 2.125 . . . . 0.0 109.981 -171.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -134.01 134.63 42.67 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.489 1.116 . . . . 0.0 111.712 -174.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -135.24 154.65 51.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.062 1.345 . . . . 0.0 111.287 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -134.74 134.81 41.4 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.133 2.173 . . . . 0.0 108.573 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.04 122.19 2.78 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 124.828 1.204 . . . . 0.0 111.901 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.6 p -105.68 114.55 28.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.554 1.142 . . . . 0.0 111.511 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.57 145.28 17.3 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.686 1.136 . . . . 0.0 115.818 -175.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.47 -24.13 0.47 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 172.436 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -158.25 177.67 11.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.91 1.684 . . . . 0.0 109.699 156.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.406 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 28.4 mtmm -49.28 -36.2 19.99 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 126.545 1.938 . . . . 0.0 115.149 177.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -13.08 1.26 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 170.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.6 tp -125.53 -42.71 1.93 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.884 2.074 . . . . 0.0 110.862 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.406 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.45 -54.62 41.53 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.584 -1.322 . . . . 0.0 111.61 173.025 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.559 ' HG2' HG13 ' A' ' 7' ' ' VAL . 9.4 ttmt -55.48 -42.5 74.45 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.071 -1.442 . . . . 0.0 111.676 167.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.34 -51.42 66.81 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 121.238 1.836 . . . . 0.0 112.838 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -55.25 -56.33 21.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 129.495 3.118 . . . . 0.0 112.493 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.22 -53.54 54.79 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.836 1.254 . . . . 0.0 112.577 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.48 -56.46 9.69 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 126.409 1.884 . . . . 0.0 112.037 170.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -53.81 -48.0 70.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.697 1.599 . . . . 0.0 112.452 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.1 m -55.29 -57.92 9.84 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.581 1.152 . . . . 0.0 112.743 172.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -58.22 8.58 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.63 1.172 . . . . 0.0 111.762 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.417 ' HG ' ' CE2' ' A' ' 67' ' ' PHE . 0.5 OUTLIER -40.23 -59.43 1.28 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.416 2.687 . . . . 0.0 110.86 173.529 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.81 -56.66 15.52 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.174 0.443 . . . . 0.0 111.489 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 93.0 m -55.25 -70.35 0.11 Allowed 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 176.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.259 12.0 m -55.46 -40.85 60.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.417 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 6.8 m-30 -60.46 -40.24 90.47 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.166 -1.584 . . . . 0.0 114.212 170.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -35.14 65.23 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.262 1.392 . . . . 0.0 114.456 162.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt . . . . . 0 N--CA 1.481 1.094 0 CA-C-N 118.829 0.741 . . . . 0.0 112.999 169.548 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo . . . . . 0 C--O 1.234 0.307 0 N-CA-C 113.933 0.705 . . . . 0.0 113.933 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.501 HG13 ' HG2' ' A' ' 55' ' ' LYS . 86.4 t -55.18 -49.34 72.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 173.056 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -46.85 75.98 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.0 mt -55.85 -56.17 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 119.611 1.096 . . . . 0.0 111.212 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.507 HD21 ' HE2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -54.83 -43.73 73.26 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.127 0.971 . . . . 0.0 112.719 -179.672 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -56.22 -58.02 9.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 127.006 2.122 . . . . 0.0 112.501 172.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -55.21 -55.02 36.04 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.81 2.044 . . . . 0.0 112.359 177.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mt -55.97 -38.15 70.01 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 171.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.288 0.0 OUTLIER 24.11 65.39 0.4 Allowed Pre-proline 0 N--CA 1.488 1.459 0 C-N-CA 127.399 2.28 . . . . 0.0 115.156 -168.724 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.53 55.93 3.83 Favored 'Trans proline' 0 CA--C 1.549 1.249 0 C-N-CA 124.811 3.674 . . . . 0.0 113.566 -173.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 63.19 24.27 67.05 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 125.8 1.666 . . . . 0.0 115.431 173.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.486 HD21 ' CD2' ' A' ' 10' ' ' LEU . 3.1 pp -90.62 173.3 8.12 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.494 1.147 . . . . 0.0 112.998 -172.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -133.26 134.93 44.58 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.823 0.849 . . . . 0.0 111.19 169.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.507 ' HE2' HD21 ' A' ' 10' ' ' LEU . 10.5 m-85 -104.49 135.3 46.17 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.59 1.556 . . . . 0.0 109.888 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -123.3 135.53 54.26 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 126.822 2.049 . . . . 0.0 109.793 179.014 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -104.72 130.42 52.79 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 122.754 1.264 . . . . 0.0 111.906 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.08 157.35 47.16 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 129.617 3.167 . . . . 0.0 108.386 -171.331 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.4 p . . . . . 0 C--N 1.319 -0.73 0 C-N-CA 125.489 1.516 . . . . 0.0 111.656 172.842 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 104.038 -2.578 . . . . 0.0 104.038 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.6 t -115.17 130.32 69.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 122.153 0.978 . . . . 0.0 108.976 -168.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 52.7 mmm -117.03 119.45 35.32 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.513 0.725 . . . . 0.0 109.797 177.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.97 138.37 41.29 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.883 1.273 . . . . 0.0 110.207 177.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.466 HG13 ' CG ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -133.14 136.0 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.28 -0.887 . . . . 0.0 111.866 -177.881 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.35 127.07 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 161.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.3 141.93 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.897 1.679 . . . . 0.0 108.787 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.7 t70 56.65 -79.92 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 126.225 1.81 . . . . 0.0 113.698 -173.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -161.75 24.99 0.24 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 129.049 3.214 . . . . 0.0 110.418 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -124.35 156.68 36.62 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.182 2.593 . . . . 0.0 109.05 -169.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -134.61 136.93 43.27 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.952 0.901 . . . . 0.0 111.4 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -135.1 159.54 41.2 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.17 0.988 . . . . 0.0 111.736 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -131.12 129.21 41.55 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.727 2.011 . . . . 0.0 108.388 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.77 117.86 3.02 Favored Glycine 0 C--O 1.227 -0.301 0 C-N-CA 124.828 1.204 . . . . 0.0 110.293 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 p -104.72 116.32 31.83 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.475 1.11 . . . . 0.0 109.421 -173.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.404 ' HA3' ' N ' ' A' ' 54' ' ' ALA . . . -142.32 135.89 6.9 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 120.941 -1.1 . . . . 0.0 115.592 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.9 ttt85 -40.6 -22.9 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 170.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -153.53 -177.98 6.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.483 1.113 . . . . 0.0 111.16 147.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.439 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 35.4 mtmt -49.24 -37.5 23.54 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 126.644 1.978 . . . . 0.0 114.797 177.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -13.91 1.69 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 171.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.6 tp -121.58 -44.48 2.34 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.99 2.116 . . . . 0.0 110.26 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.66 -57.19 13.01 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 125.666 1.586 . . . . 0.0 112.4 175.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.501 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.5 ttmt -55.23 -44.28 75.32 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 116.507 -1.711 . . . . 0.0 110.936 168.215 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.57 -50.93 68.78 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 121.924 2.147 . . . . 0.0 112.741 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.6 mmm-85 -54.54 -58.6 6.86 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.146 2.178 . . . . 0.0 111.555 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.66 -54.16 47.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.941 0.897 . . . . 0.0 112.872 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.92 -55.85 15.19 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 126.88 2.072 . . . . 0.0 112.863 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -47.88 74.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 121.019 1.736 . . . . 0.0 111.406 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.0 m -55.05 -53.61 53.62 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.215 0.606 . . . . 0.0 112.049 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.06 -59.59 4.55 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.398 1.479 . . . . 0.0 111.734 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.43 -63.46 0.82 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 128.37 2.668 . . . . 0.0 110.627 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.95 -49.92 70.19 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.018 0.527 . . . . 0.0 111.082 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 46.4 m -55.24 -71.35 0.09 Allowed 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.276 11.4 m -55.59 -44.22 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.721 1.208 . . . . 0.0 114.062 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -55.97 -47.97 76.69 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 170.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -36.43 69.01 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.249 1.386 . . . . 0.0 113.903 168.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 124.405 1.082 . . . . 0.0 111.273 172.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo . . . . . 0 N--CA 1.461 -0.423 0 N-CA-C 113.607 0.58 . . . . 0.0 113.607 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.446 HG22 ' HB3' ' A' ' 55' ' ' LYS . 59.9 t -54.46 -52.95 34.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.146 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -55.91 -53.02 61.93 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 116.051 1.871 . . . . 0.0 116.051 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.1 pt -57.66 -48.21 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.27 0.941 . . . . 0.0 113.507 171.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -55.71 -41.51 73.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 174.455 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.13 -56.67 17.28 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.527 1.931 . . . . 0.0 111.804 171.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.274 1.8 pt-20 -57.39 -59.78 4.63 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 175.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -55.8 -33.71 64.66 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 176.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.277 0.0 OUTLIER 15.04 67.87 0.16 Allowed Pre-proline 0 N--CA 1.487 1.415 0 C-N-CA 129.523 3.129 . . . . 0.0 118.092 -175.633 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.17 43.14 0.09 OUTLIER 'Trans proline' 0 CA--C 1.558 1.683 1 C-N-CA 125.921 4.414 . . . . 0.0 118.848 -175.289 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.45 32.85 24.05 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 120.065 -1.647 . . . . 0.0 113.771 177.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -103.8 166.63 10.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -166.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -134.79 138.77 44.57 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.922 2.089 . . . . 0.0 111.692 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -104.54 135.26 46.29 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.715 1.206 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -118.51 135.27 54.49 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 127.619 2.368 . . . . 0.0 109.261 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -108.66 124.78 51.05 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 122.331 1.062 . . . . 0.0 111.874 -174.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.417 ' HB2' HG13 ' A' ' 34' ' ' VAL . 3.8 mp -131.9 167.51 19.49 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 129.895 3.278 . . . . 0.0 106.309 -173.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.9 p . . . . . 0 C--N 1.321 -0.638 0 O-C-N 119.937 -1.727 . . . . 0.0 113.168 159.93 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 . . . . . 0 N--CA 1.457 -0.098 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.417 HG13 ' HB2' ' A' ' 22' ' ' LEU 0.327 0.1 OUTLIER -107.53 135.02 47.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 122.745 1.26 . . . . 0.0 112.561 175.759 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 76.1 mmm -125.16 117.33 23.64 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.406 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.3 m -115.83 135.19 54.24 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.386 0.674 . . . . 0.0 109.709 -172.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -121.33 135.81 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.446 1.098 . . . . 0.0 112.067 -174.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.3 t -104.41 125.98 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 165.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.3 p -146.71 145.37 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 126.878 2.071 . . . . 0.0 109.095 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.5 t70 62.16 -23.66 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 130.62 3.78 4.52 Favored Glycine 0 CA--C 1.544 1.87 0 C-N-CA 126.569 2.033 . . . . 0.0 113.585 -167.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -135.02 165.7 24.74 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.192 2.197 . . . . 0.0 111.832 -173.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.23 137.22 44.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.365 1.066 . . . . 0.0 112.689 -163.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -135.03 150.72 50.35 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.131 1.773 . . . . 0.0 110.809 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.53 110.55 10.56 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.288 1.035 . . . . 0.0 110.557 -174.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.97 109.1 3.21 Favored Glycine 0 CA--C 1.527 0.792 0 C-N-CA 126.018 1.771 . . . . 0.0 112.018 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.0 m -108.02 104.94 14.49 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.052 0.926 . . . . 0.0 112.601 -172.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.45 136.46 7.89 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.832 1.682 . . . . 0.0 114.791 -172.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -13.63 -59.1 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 127.057 2.143 . . . . 0.0 116.739 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -136.94 177.2 8.05 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.067 1.747 . . . . 0.0 109.908 169.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -46.88 -46.01 20.82 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 120.015 1.28 . . . . 0.0 114.093 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.63 -23.43 1.7 Allowed 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 174.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -108.39 -40.19 5.21 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.235 1.414 . . . . 0.0 111.31 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.39 -56.83 15.63 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.694 1.197 . . . . 0.0 112.575 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.446 ' HB3' HG22 ' A' ' 7' ' ' VAL . 11.0 mmtt -55.41 -35.63 65.56 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 115.698 -2.096 . . . . 0.0 113.249 165.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.55 -54.81 39.36 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 122.501 2.41 . . . . 0.0 110.94 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -55.0 -53.26 58.04 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.305 2.242 . . . . 0.0 114.05 169.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.51 -56.67 17.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.225 1.01 . . . . 0.0 111.952 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.33 -60.07 2.55 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.291 1.036 . . . . 0.0 113.207 166.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -50.51 -48.43 57.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.336 1.454 . . . . 0.0 112.92 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.12 -59.16 5.15 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 112.486 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.17 -57.1 13.13 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.869 -1.062 . . . . 0.0 111.998 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -42.15 -64.32 0.61 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.288 2.635 . . . . 0.0 111.121 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.82 66.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.129 0.422 . . . . 0.0 111.092 -178.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 41.0 m -55.44 -73.17 0.06 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 175.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.253 11.6 m -55.52 -42.02 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.73 1.212 . . . . 0.0 113.845 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -56.63 -47.02 80.59 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.638 1.108 . . . . 0.0 113.4 169.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -55.3 -33.8 63.58 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 169.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt . . . . . 0 N--CA 1.479 1.018 0 CA-C-N 119.242 0.928 . . . . 0.0 110.746 167.567 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 CA--C 1.53 0.301 0 N-CA-C 114.58 0.954 . . . . 0.0 114.58 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.426 HG22 ' HB3' ' A' ' 55' ' ' LYS . 42.3 t -54.99 -50.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 122.152 0.977 . . . . 0.0 109.067 172.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.54 -49.99 71.19 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.258 10.7 pt -58.8 -48.89 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-N 120.653 1.569 . . . . 0.0 114.563 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.283 0.0 OUTLIER -55.53 -39.95 71.21 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.022 -1.049 . . . . 0.0 113.434 176.045 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -58.57 7.12 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.614 1.966 . . . . 0.0 112.117 167.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.8 -54.93 38.46 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.408 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 11.5 mt -55.9 -42.19 75.64 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.139 1.375 . . . . 0.0 114.584 172.135 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 27.38 65.17 0.59 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 128.369 2.668 . . . . 0.0 116.202 -171.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.97 74.74 0.05 OUTLIER 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 124.953 3.769 . . . . 0.0 117.117 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.86 35.15 89.73 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.691 1.615 . . . . 0.0 114.936 173.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 pp -111.81 157.46 20.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -154.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.78 141.09 44.74 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 127.419 2.288 . . . . 0.0 114.175 167.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -104.48 135.36 46.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.451 1.101 . . . . 0.0 111.44 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.58 135.43 48.12 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.909 2.083 . . . . 0.0 110.064 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -104.58 129.69 52.65 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 123.312 1.53 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -134.76 145.33 48.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 130.369 3.468 . . . . 0.0 105.944 -168.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.6 t . . . . . 0 C--N 1.317 -0.845 0 O-C-N 118.921 -2.362 . . . . 0.0 108.264 -171.971 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 . . . . . 0 CA--C 1.509 -0.624 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 98.0 t -118.07 134.88 60.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 123.3 1.524 . . . . 0.0 109.45 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.06 124.29 46.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 171.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.3 t -120.22 134.35 55.28 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.676 0.671 . . . . 0.0 111.139 169.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -121.51 135.63 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.548 0.739 . . . . 0.0 110.322 -169.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -94.85 114.27 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.2 t -138.52 137.0 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.596 1.958 . . . . 0.0 108.337 -168.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 t70 59.02 -66.34 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.75 2.02 . . . . 0.0 114.044 -170.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 18.97 0.06 OUTLIER Glycine 0 CA--C 1.542 1.737 0 C-N-CA 128.031 2.729 . . . . 0.0 112.692 170.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -135.21 165.11 26.17 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.931 2.492 . . . . 0.0 110.944 -168.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -127.01 128.68 46.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.756 0.822 . . . . 0.0 112.508 -162.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -135.11 103.3 5.5 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.445 1.098 . . . . 0.0 113.533 -164.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -77.84 135.26 37.9 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 127.605 2.362 . . . . 0.0 110.432 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.98 123.67 3.19 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 125.948 1.737 . . . . 0.0 110.34 174.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.2 t -113.63 113.01 24.45 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.817 0.847 . . . . 0.0 111.175 -173.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.74 149.91 20.17 Favored Glycine 0 CA--C 1.529 0.939 0 C-N-CA 125.387 1.47 . . . . 0.0 115.767 -174.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -53.32 -23.01 8.17 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 175.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -157.7 -174.82 5.05 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.94 1.696 . . . . 0.0 110.288 152.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -45.19 -49.24 12.31 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.993 1.717 . . . . 0.0 114.27 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -14.15 1.13 Allowed 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.5 tp -114.66 -41.31 3.43 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.334 1.854 . . . . 0.0 111.294 172.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -55.29 33.47 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.371 174.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.426 ' HB3' HG22 ' A' ' 7' ' ' VAL . 13.5 mmtt -55.35 -41.93 73.2 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-O 115.413 -2.232 . . . . 0.0 113.593 162.04 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -50.19 70.59 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 123.444 2.838 . . . . 0.0 111.17 -178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -54.99 -58.16 8.77 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 129.222 3.009 . . . . 0.0 113.259 168.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -56.38 20.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.673 1.189 . . . . 0.0 112.168 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -44.86 -60.33 2.1 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.271 1.428 . . . . 0.0 114.454 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -55.01 -45.45 75.1 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.794 1.179 . . . . 0.0 112.716 -177.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.48 -56.84 15.56 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.32 1.048 . . . . 0.0 112.507 171.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -59.35 4.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.62 1.168 . . . . 0.0 112.24 177.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -57.62 5.82 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.871 2.068 . . . . 0.0 111.884 178.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.97 -49.07 72.33 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.133 0.424 . . . . 0.0 111.331 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -55.28 -68.06 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.3 m -55.47 -46.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -177.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.408 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 8.8 m-30 -55.94 -48.34 75.92 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -38.07 69.08 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.054 0.843 . . . . 0.0 112.556 170.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.549 0.929 0 C-N-CA 124.504 1.122 . . . . 0.0 110.181 168.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo . . . . . 0 C--O 1.236 0.414 0 N-CA-C 114.659 0.984 . . . . 0.0 114.659 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.531 HG13 ' HG2' ' A' ' 55' ' ' LYS . 95.5 t -54.78 -50.83 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -55.29 -44.45 75.74 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.993 1.317 . . . . 0.0 114.401 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.438 ' H ' HG13 ' A' ' 9' ' ' ILE . 8.5 mt -55.92 -59.51 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 125.254 1.422 . . . . 0.0 112.316 168.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.264 0.0 OUTLIER -55.54 -39.31 70.4 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.696 0.798 . . . . 0.0 112.447 -179.556 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.58 -57.71 10.8 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 127.538 2.335 . . . . 0.0 112.163 168.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -55.37 -58.05 9.34 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.601 1.56 . . . . 0.0 112.001 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 13.3 mt -55.82 -35.76 66.73 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.423 ' HA ' ' HD2' ' A' ' 15' ' ' PRO 0.366 0.0 OUTLIER -10.11 90.71 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.238 0 C-N-CA 127.835 2.454 . . . . 0.0 117.387 -161.883 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 14' ' ' ARG . 74.0 Cg_endo -66.98 -166.1 0.11 Allowed 'Trans proline' 0 CA--C 1.549 1.234 0 C-N-CA 122.457 2.105 . . . . 0.0 111.544 169.251 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.43 66.04 0.4 Allowed Glycine 0 CA--C 1.539 1.547 0 O-C-N 120.631 -1.293 . . . . 0.0 114.117 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 pp -112.0 167.14 10.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.848 1.659 . . . . 0.0 113.343 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -135.23 138.87 43.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.54 1.536 . . . . 0.0 112.443 167.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -104.25 135.24 46.09 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.353 1.073 . . . . 0.0 109.62 172.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -114.08 135.33 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 127.83 2.452 . . . . 0.0 108.568 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -107.04 119.65 39.96 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.351 1.072 . . . . 0.0 111.147 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.38 150.48 45.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 129.827 3.251 . . . . 0.0 106.808 -177.374 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.2 p . . . . . 0 C--N 1.321 -0.671 0 O-C-N 120.343 -1.473 . . . . 0.0 112.068 174.652 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 . . . . . 0 N--CA 1.447 -0.603 0 N-CA-C 103.994 -2.595 . . . . 0.0 103.994 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -116.49 114.16 45.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -158.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 72.9 mmm -104.72 118.49 36.7 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.2 m -123.72 135.29 53.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.819 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.27 135.88 53.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 123.714 0.806 . . . . 0.0 109.671 -158.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.0 t -104.13 112.85 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.0 t -137.96 136.35 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.893 2.077 . . . . 0.0 107.963 -164.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.1 t70 59.83 -65.62 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 127.213 2.205 . . . . 0.0 114.167 -171.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -174.92 20.66 0.05 OUTLIER Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.117 2.77 . . . . 0.0 112.033 174.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.09 166.84 22.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 127.248 2.219 . . . . 0.0 109.613 -167.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -121.87 138.53 54.36 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.995 0.918 . . . . 0.0 111.779 -175.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -134.77 148.3 50.2 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.083 1.753 . . . . 0.0 109.519 -173.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -133.94 131.49 39.09 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.618 1.167 . . . . 0.0 109.985 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -129.37 113.45 1.52 Allowed Glycine 0 CA--C 1.522 0.474 0 C-N-CA 125.077 1.322 . . . . 0.0 111.381 -173.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -104.81 104.69 14.51 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.115 0.966 . . . . 0.0 111.171 -172.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.01 137.97 9.54 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 124.496 1.046 . . . . 0.0 115.42 -176.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -35.76 -44.41 0.34 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 115.383 1.623 . . . . 0.0 115.383 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -139.97 179.19 6.75 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.292 1.037 . . . . 0.0 111.171 158.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 54.2 mttp -47.25 -35.1 7.25 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 126.589 1.955 . . . . 0.0 115.838 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.07 -15.4 5.21 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.5 tp -124.04 -41.74 2.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.267 2.227 . . . . 0.0 110.728 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.432 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.7 -58.27 8.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.967 1.307 . . . . 0.0 112.912 172.519 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.531 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.0 ttmt -55.25 -46.34 76.08 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-O 116.886 -1.531 . . . . 0.0 110.127 169.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.59 75.0 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 121.594 1.997 . . . . 0.0 113.174 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -55.39 -57.5 11.61 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 170.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.93 49.92 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.489 0.716 . . . . 0.0 112.574 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.19 -59.11 4.25 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.635 2.374 . . . . 0.0 112.455 172.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.12 -49.42 71.82 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.998 1.272 . . . . 0.0 111.687 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.7 m -55.42 -55.07 35.87 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.029 0.932 . . . . 0.0 112.542 175.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -55.74 27.8 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.769 1.228 . . . . 0.0 111.841 175.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.42 -57.82 2.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.481 2.312 . . . . 0.0 110.68 175.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.87 -54.17 45.98 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 122.834 0.454 . . . . 0.0 111.638 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.3 m -55.15 -68.69 0.17 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.278 21.1 m -55.51 -46.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -57.74 -46.66 84.17 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.72 -36.79 67.62 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.391 1.45 . . . . 0.0 113.635 169.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.548 0.894 0 C-N-CA 124.864 1.265 . . . . 0.0 111.466 169.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo . . . . . 0 C--O 1.236 0.38 0 N-CA-C 115.275 1.221 . . . . 0.0 115.275 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.449 HG22 ' HB3' ' A' ' 55' ' ' LYS . 59.5 t -46.87 -58.59 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.117 0.967 . . . . 0.0 109.264 169.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.0 tpp -55.69 -43.91 76.85 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.7 1.6 . . . . 0.0 114.412 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.1 mt -55.59 -59.67 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.389 0.995 . . . . 0.0 110.928 173.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.419 ' HB2' HD13 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -50.28 -48.41 54.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.489 1.516 . . . . 0.0 111.236 176.278 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -57.89 -55.38 35.59 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 124.72 1.208 . . . . 0.0 113.881 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -56.45 -45.3 80.89 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.274 1.83 . . . . 0.0 113.765 174.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.58 -37.68 68.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.201 1.8 . . . . 0.0 112.951 169.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.8 ptt-85 34.8 66.4 1.49 Allowed Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 127.63 2.372 . . . . 0.0 114.412 -178.271 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.71 60.64 1.19 Allowed 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 124.922 3.748 . . . . 0.0 113.06 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.92 25.99 64.81 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.019 1.771 . . . . 0.0 115.064 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.413 ' HB3' HG12 ' A' ' 39' ' ' VAL . 1.1 pp -79.06 162.05 26.15 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 116.432 2.012 . . . . 0.0 116.432 -159.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -135.21 137.18 42.39 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.303 2.241 . . . . 0.0 110.713 164.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -104.39 135.32 46.05 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 124.587 1.18 . . . . 0.0 111.465 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -121.28 135.57 55.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 127.614 2.366 . . . . 0.0 109.68 -177.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -104.49 124.16 48.78 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 122.772 1.272 . . . . 0.0 109.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.429 ' CB ' HG13 ' A' ' 34' ' ' VAL . 1.3 mm? -123.84 159.46 29.53 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 130.239 3.416 . . . . 0.0 103.645 178.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.6 p . . . . . 0 N--CA 1.473 0.711 0 O-C-N 118.753 -2.467 . . . . 0.0 112.847 167.309 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 N--CA 1.45 -0.457 0 CA-C-O 121.766 0.793 . . . . 0.0 109.607 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . 0.429 HG13 ' CB ' ' A' ' 22' ' ' LEU 0.258 0.1 OUTLIER -104.96 134.5 46.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 122.843 1.306 . . . . 0.0 111.768 167.38 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 67.1 mmm -117.76 127.13 53.61 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -122.96 135.24 54.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -119.58 135.71 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 111.076 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.8 t -102.25 124.67 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 104.87 -2.27 . . . . 0.0 104.87 161.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.413 HG12 ' HB3' ' A' ' 17' ' ' LEU . 4.8 m -138.29 150.28 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.936 2.094 . . . . 0.0 108.159 -173.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.2 t70 54.97 -79.28 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 125.204 1.401 . . . . 0.0 113.552 -175.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -159.67 20.9 0.27 Allowed Glycine 0 CA--C 1.544 1.844 0 C-N-CA 127.988 2.709 . . . . 0.0 112.5 167.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -135.13 170.29 16.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.834 2.453 . . . . 0.0 112.583 -172.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -134.5 136.44 43.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.92 0.888 . . . . 0.0 112.991 -162.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.421 ' HZ ' HG21 ' A' ' 65' ' ' THR . 44.1 m-85 -134.98 149.6 50.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.049 1.74 . . . . 0.0 111.102 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -132.27 125.95 32.24 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.897 1.279 . . . . 0.0 109.846 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.05 112.91 2.12 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 126.019 1.771 . . . . 0.0 111.569 -169.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -104.9 112.84 26.12 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.432 1.116 . . . . 0.0 111.059 -170.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.69 136.42 8.46 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 125.694 1.616 . . . . 0.0 116.702 -165.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.1 mmm-85 -55.51 -13.81 1.72 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 170.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -152.88 165.59 34.96 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 128.186 2.594 . . . . 0.0 109.139 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -51.37 -42.83 61.63 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 121.158 1.799 . . . . 0.0 113.376 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -5.7 3.44 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 174.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.58 -50.93 3.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.214 1.406 . . . . 0.0 109.067 170.2 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.36 -59.4 4.85 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.594 1.958 . . . . 0.0 113.459 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HB3' HG22 ' A' ' 7' ' ' VAL . 6.7 mmtt -55.53 -38.34 69.11 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 115.479 -2.2 . . . . 0.0 113.081 163.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 -50.77 68.89 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 123.462 2.847 . . . . 0.0 111.944 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -55.34 -58.25 8.49 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.269 3.428 . . . . 0.0 113.347 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.4 -56.31 21.6 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.066 1.347 . . . . 0.0 111.593 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.68 -55.28 11.77 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 168.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -55.1 -47.75 74.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 120.822 1.646 . . . . 0.0 112.911 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -55.12 -56.69 16.98 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.54 1.136 . . . . 0.0 112.298 172.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -55.04 35.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.638 1.175 . . . . 0.0 112.279 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.419 HD13 ' HB2' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -48.37 -60.83 2.36 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.762 2.425 . . . . 0.0 109.8 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.09 -48.45 73.55 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.774 0.43 . . . . 0.0 111.31 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.421 HG21 ' HZ ' ' A' ' 44' ' ' PHE . 49.2 m -55.37 -69.3 0.14 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.772 1.026 . . . . 0.0 113.772 173.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.4 m -55.27 -41.33 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.287 0.948 . . . . 0.0 112.957 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.23 -45.24 80.05 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.82 -1.175 . . . . 0.0 113.724 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -36.53 67.2 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 164.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.4 mt . . . . . 0 N--CA 1.484 1.238 0 CA-C-N 119.518 1.054 . . . . 0.0 112.598 169.65 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo . . . . . 0 C--O 1.237 0.469 0 N-CA-C 114.77 1.027 . . . . 0.0 114.77 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.712 HG13 ' HG2' ' A' ' 55' ' ' LYS . 57.3 t -55.06 -50.28 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 173.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.08 -45.06 75.37 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.682 1.193 . . . . 0.0 113.208 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 12.2 mt -55.65 -63.6 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.342 1.057 . . . . 0.0 110.874 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -41.69 72.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.964 0.906 . . . . 0.0 112.842 -176.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.36 -63.64 1.1 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.093 1.757 . . . . 0.0 111.442 174.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -56.01 -48.9 75.05 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.403 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 1.7 mt -55.66 -35.0 65.48 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 172.006 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 ptt-85 33.94 59.16 1.95 Allowed Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 127.259 2.224 . . . . 0.0 115.2 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -68.01 70.78 0.84 Allowed 'Trans proline' 0 CA--C 1.548 1.203 0 C-N-CA 124.665 3.577 . . . . 0.0 114.241 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.16 30.02 74.58 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.966 1.746 . . . . 0.0 114.911 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -99.6 163.88 12.31 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 117.115 2.265 . . . . 0.0 117.115 -156.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.37 141.95 45.64 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 127.127 2.171 . . . . 0.0 112.065 161.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.428 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 29.7 m-85 -104.57 135.24 46.35 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.413 1.102 . . . . 0.0 110.874 176.688 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -107.46 135.73 48.44 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 128.478 2.711 . . . . 0.0 109.9 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -104.61 127.98 52.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 122.751 1.262 . . . . 0.0 110.352 174.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.9 135.83 41.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 130.014 3.326 . . . . 0.0 106.11 -171.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 t . . . . . 0 C--N 1.321 -0.662 0 N-CA-C 118.476 2.769 . . . . 0.0 118.476 -166.691 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 . . . . . 0 CA--C 1.512 -0.488 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.9 t -115.31 125.64 72.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 123.382 1.563 . . . . 0.0 108.696 -161.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.6 mmt -112.34 122.58 48.13 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.019 -1.446 . . . . 0.0 107.731 173.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -122.82 135.52 54.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.428 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -128.62 135.68 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.14 0.976 . . . . 0.0 111.365 -168.113 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.5 t -104.23 122.96 57.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 105.619 -1.993 . . . . 0.0 105.619 166.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -142.33 151.08 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.325 1.85 . . . . 0.0 108.37 -175.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.5 t70 58.01 -70.5 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.328 1.851 . . . . 0.0 114.13 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.22 18.45 0.09 OUTLIER Glycine 0 CA--C 1.543 1.817 0 C-N-CA 128.037 2.732 . . . . 0.0 112.946 167.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -135.33 169.45 17.46 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.756 2.422 . . . . 0.0 112.382 -168.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -134.21 138.83 45.38 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.466 1.106 . . . . 0.0 113.524 -166.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -135.12 158.75 43.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.874 1.67 . . . . 0.0 112.318 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -128.75 135.05 48.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.892 2.077 . . . . 0.0 109.449 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.86 122.21 3.13 Favored Glycine 0 CA--C 1.524 0.646 0 C-N-CA 125.494 1.521 . . . . 0.0 111.304 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 m -118.07 104.74 11.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 117.896 0.848 . . . . 0.0 110.903 -168.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 146.2 18.19 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.43 1.967 . . . . 0.0 114.347 -170.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -44.71 -33.06 1.71 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -155.51 179.31 9.3 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.881 1.672 . . . . 0.0 109.684 162.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.5 mtmt -43.39 -41.87 4.39 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 127.636 2.374 . . . . 0.0 115.709 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.99 -15.92 4.16 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 174.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -122.92 -42.48 2.29 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.931 2.092 . . . . 0.0 111.297 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.42 -57.89 10.02 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.227 1.411 . . . . 0.0 112.295 172.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.712 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.7 ttmt -55.37 -44.46 76.05 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-O 117.586 -1.197 . . . . 0.0 110.863 170.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 -51.9 65.0 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 120.341 1.428 . . . . 0.0 113.463 178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.6 mmm-85 -55.36 -53.39 56.8 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.164 1.785 . . . . 0.0 113.24 170.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.79 65.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.97 0.908 . . . . 0.0 112.319 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.71 67.63 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 127.298 2.239 . . . . 0.0 112.403 171.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -55.01 -51.01 67.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.234 1.414 . . . . 0.0 111.822 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -55.26 -54.0 48.97 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.868 0.867 . . . . 0.0 112.812 171.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.23 -55.95 25.48 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.611 1.165 . . . . 0.0 113.19 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -59.8 3.5 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 127.826 2.45 . . . . 0.0 110.545 177.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.23 -49.6 69.07 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.177 0.298 . . . . 0.0 111.078 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 44.8 m -55.28 -72.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.541 1.136 . . . . 0.0 113.98 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.251 24.4 m -55.54 -46.17 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.403 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 5.8 m-30 -59.64 -44.69 93.41 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 174.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -55.58 -39.36 70.6 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.916 1.235 . . . . 0.0 113.887 168.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.552 1.041 0 C-N-CA 125.579 1.552 . . . . 0.0 112.215 167.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo . . . . . 0 CA--C 1.529 0.231 0 CA-C-O 118.649 -0.646 . . . . 0.0 113.627 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.711 HG13 ' HG2' ' A' ' 55' ' ' LYS . 60.4 t -55.07 -50.3 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.165 0.893 . . . . 0.0 109.214 173.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.28 -53.6 54.07 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.944 1.298 . . . . 0.0 114.271 -177.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 15.0 pt -58.71 -49.88 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 172.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.4 ' HB2' ' CD1' ' A' ' 63' ' ' LEU 0.252 0.0 OUTLIER -55.59 -45.33 77.42 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.663 1.12 . . . . 0.0 113.838 176.981 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.13 -56.46 19.67 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 127.106 2.163 . . . . 0.0 111.432 174.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.61 -63.82 1.05 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.111 1.364 . . . . 0.0 114.042 173.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.7 mt -55.54 -23.73 28.2 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 35.92 51.21 1.5 Allowed Pre-proline 0 N--CA 1.48 1.07 0 C-N-CA 127.557 2.343 . . . . 0.0 114.778 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.73 46.85 1.99 Allowed 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 124.657 3.571 . . . . 0.0 116.012 -156.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.04 20.16 Favored Glycine 0 CA--C 1.534 1.251 0 O-C-N 120.521 -1.362 . . . . 0.0 113.538 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -97.58 166.27 11.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.774 1.63 . . . . 0.0 114.933 -173.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.63 150.77 49.74 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.299 1.44 . . . . 0.0 112.654 145.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.55 135.83 45.25 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.842 1.257 . . . . 0.0 112.145 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -124.66 135.72 53.31 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.695 1.598 . . . . 0.0 110.266 166.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -104.42 135.14 46.42 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 123.381 1.562 . . . . 0.0 110.678 -175.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -134.5 161.74 34.21 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 131.691 3.996 . . . . 0.0 106.1 -164.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.7 m . . . . . 0 C--N 1.319 -0.759 0 O-C-N 119.64 -1.913 . . . . 0.0 112.488 158.026 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 104.488 -2.412 . . . . 0.0 104.488 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 69.2 t -120.76 130.07 74.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.29 1.043 . . . . 0.0 110.841 -159.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 13.5 mmm -109.22 123.23 48.91 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 171.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.6 p -104.88 135.62 45.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.227 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -125.25 135.47 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.788 -0.57 . . . . 0.0 111.264 172.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.3 t -104.54 124.16 58.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 165.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.4 p -152.28 140.96 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.305 1.042 . . . . 0.0 110.174 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.5 t70 62.3 -25.16 0.05 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.937 2.095 . . . . 0.0 116.327 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 133.17 -4.76 4.95 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 126.939 2.209 . . . . 0.0 112.886 -165.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -105.02 168.02 9.33 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.223 2.209 . . . . 0.0 110.808 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -135.09 139.89 45.08 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.076 1.35 . . . . 0.0 110.643 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -135.06 150.84 50.34 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.529 1.132 . . . . 0.0 111.041 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -115.29 135.09 54.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.025 1.73 . . . . 0.0 109.351 166.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.62 114.22 2.79 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 125.11 1.338 . . . . 0.0 110.373 168.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.8 p -104.83 108.86 20.57 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 122.577 1.18 . . . . 0.0 109.601 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.44 140.8 11.97 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 126.192 1.853 . . . . 0.0 113.283 -165.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -17.07 6.16 Favored 'General case' 0 CA--C 1.557 1.237 0 O-C-N 121.291 -1.123 . . . . 0.0 113.947 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -160.42 162.24 33.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 129.429 3.092 . . . . 0.0 109.584 170.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.46 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 50.2 mttp -43.93 -37.73 3.04 Favored 'General case' 0 N--CA 1.5 2.063 0 CA-C-N 121.707 2.048 . . . . 0.0 115.455 172.312 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -14.43 7.4 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 120.159 1.345 . . . . 0.0 114.218 174.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.0 tp -122.24 -40.0 2.53 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.294 2.238 . . . . 0.0 111.897 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.67 -55.25 34.33 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.405 -1.434 . . . . 0.0 111.737 173.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.711 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.5 ttmt -55.32 -41.84 72.96 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-O 117.785 -1.102 . . . . 0.0 111.768 168.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.58 -50.78 69.17 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 120.429 1.468 . . . . 0.0 113.677 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -55.5 -54.06 48.66 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 128.563 2.745 . . . . 0.0 112.661 169.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -53.82 51.39 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.869 1.268 . . . . 0.0 111.672 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.43 -56.82 8.39 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 126.794 2.038 . . . . 0.0 112.269 169.046 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -52.64 -49.41 65.24 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.112 1.365 . . . . 0.0 112.525 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.22 -57.94 9.72 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.105 1.362 . . . . 0.0 112.165 173.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.464 ' O ' HG22 ' A' ' 66' ' ' VAL . . . -55.18 -56.73 16.62 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.651 1.18 . . . . 0.0 112.354 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.4 ' CD1' ' HB2' ' A' ' 10' ' ' LEU . 0.4 OUTLIER -44.5 -63.82 0.82 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 128.208 2.603 . . . . 0.0 110.82 176.728 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.48 -51.65 62.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 117.82 0.282 . . . . 0.0 110.94 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.0 m -55.3 -78.25 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 62' ' ' ALA . 15.8 m -55.25 -45.75 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.433 1.015 . . . . 0.0 113.179 -174.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -57.64 -45.42 85.49 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.755 -1.215 . . . . 0.0 112.539 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . 0.319 8.1 t-20 -57.26 -31.25 65.39 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 164.549 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.1 mt . . . . . 0 N--CA 1.477 0.876 0 CA-C-N 119.709 1.14 . . . . 0.0 113.647 170.001 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo . . . . . 0 CA--C 1.527 0.157 0 N-CA-C 115.366 1.256 . . . . 0.0 115.366 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.742 HG13 ' HG2' ' A' ' 55' ' ' LYS . 46.1 t -53.87 -53.65 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.26 0.936 . . . . 0.0 109.208 173.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.3 ttt -55.53 -41.05 72.64 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.352 1.861 . . . . 0.0 114.728 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.1 mt -62.2 -59.21 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.789 1.635 . . . . 0.0 112.727 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -55.48 -35.97 66.11 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.622 0.769 . . . . 0.0 112.426 177.953 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -55.54 -58.37 8.05 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.954 1.702 . . . . 0.0 112.945 162.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.45 -49.69 71.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.038 -1.664 . . . . 0.0 113.317 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.432 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 8.0 mt -55.91 -42.38 75.94 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 170.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 11.12 80.05 0.06 OUTLIER Pre-proline 0 N--CA 1.49 1.526 0 C-N-CA 129.158 2.983 . . . . 0.0 115.321 -175.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -68.97 -173.18 0.57 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.612 2.208 . . . . 0.0 110.516 161.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -71.36 39.9 0.59 Allowed Glycine 0 CA--C 1.541 1.682 0 C-N-CA 125.202 1.382 . . . . 0.0 115.168 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -78.6 163.31 25.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.655 1.582 . . . . 0.0 112.968 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -135.54 135.95 40.77 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.557 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -104.37 135.55 45.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.033 1.333 . . . . 0.0 111.046 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.52 135.91 50.45 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 129.415 3.086 . . . . 0.0 110.367 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -104.32 128.21 52.09 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 122.66 1.219 . . . . 0.0 109.984 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.8 mp -135.03 135.74 41.56 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 129.244 3.018 . . . . 0.0 106.599 -170.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--N 1.319 -0.748 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -160.563 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 CA--C 1.504 -0.801 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.0 t -110.14 122.45 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 CA-C-N 113.384 -1.735 . . . . 0.0 106.793 -169.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 69.0 mmm -113.62 128.79 56.56 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 172.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -131.7 135.14 46.62 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.681 0.613 . . . . 0.0 110.185 -175.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -127.48 135.75 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 121.03 -1.044 . . . . 0.0 110.37 -167.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.16 118.26 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 105.115 -2.179 . . . . 0.0 105.115 168.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -118.69 -35.95 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.349 -159.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -131.26 -13.6 3.45 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.265 . . . . 0.0 113.884 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.33 -17.19 29.07 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 123.905 0.764 . . . . 0.0 112.096 -147.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -104.69 158.92 16.17 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 125.231 1.412 . . . . 0.0 110.747 163.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -135.08 141.09 46.0 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.043 1.737 . . . . 0.0 111.581 -161.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -134.99 127.54 30.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.977 1.311 . . . . 0.0 111.62 -171.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -99.23 135.17 41.02 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.215 1.806 . . . . 0.0 109.251 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.05 115.96 1.48 Allowed Glycine 0 CA--C 1.525 0.669 0 O-C-N 121.65 -0.656 . . . . 0.0 113.381 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.7 p -104.89 104.73 14.54 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.18 1.392 . . . . 0.0 111.533 -174.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.4 ' HA3' ' N ' ' A' ' 54' ' ' ALA . . . -135.95 147.27 19.12 Favored Glycine 0 CA--C 1.528 0.906 0 N-CA-C 116.266 1.266 . . . . 0.0 116.266 -173.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -47.91 -26.33 1.67 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -152.83 -174.26 4.86 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.824 1.25 . . . . 0.0 109.344 149.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.433 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 6.6 mtmp? -42.36 -38.92 1.99 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 126.522 1.929 . . . . 0.0 114.234 172.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -45.61 -30.09 1.41 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.482 1.913 . . . . 0.0 115.52 171.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.5 tp -122.28 -36.49 2.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 111.466 -175.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.433 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.72 -56.31 22.02 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.39 1.476 . . . . 0.0 112.154 170.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.742 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.2 ttmt -55.02 -46.08 75.22 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 117.228 -1.368 . . . . 0.0 109.425 169.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -49.19 72.85 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 120.664 1.574 . . . . 0.0 113.064 -179.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -55.35 -57.36 12.17 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.824 0.849 . . . . 0.0 113.209 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.47 66.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.308 0.643 . . . . 0.0 112.325 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.39 -53.77 49.55 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.969 2.508 . . . . 0.0 113.372 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -55.3 -51.44 66.68 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.149 1.34 . . . . 0.0 111.389 176.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.2 m -55.38 -49.34 72.57 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.598 1.159 . . . . 0.0 112.115 177.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.44 ' O ' HG23 ' A' ' 66' ' ' VAL . . . -55.19 -65.7 0.54 Allowed 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.393 1.477 . . . . 0.0 111.477 170.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -37.47 -57.71 0.91 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.704 2.002 . . . . 0.0 111.988 177.388 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.12 -62.55 1.59 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 m -55.45 -54.17 47.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 62' ' ' ALA . 49.8 t -55.02 -62.98 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 127.391 2.276 . . . . 0.0 109.733 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.432 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 2.7 m-30 -57.29 -42.14 81.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.78 -38.66 70.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.839 0.856 . . . . 0.0 112.448 170.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.548 0.896 0 C-N-CA 124.124 0.969 . . . . 0.0 109.9 165.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo . . . . . 0 C--O 1.235 0.364 0 N-CA-C 114.01 0.734 . . . . 0.0 114.01 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.555 HG13 ' HG2' ' A' ' 55' ' ' LYS . 78.3 t -53.82 -54.96 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 122.351 1.072 . . . . 0.0 108.124 171.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 tpt -55.62 -50.38 70.31 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 126.274 1.83 . . . . 0.0 115.816 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 9.6 pt -57.72 -51.15 73.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 120.768 1.622 . . . . 0.0 113.576 167.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.302 0.0 OUTLIER -55.57 -45.02 77.37 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.02 1.282 . . . . 0.0 114.094 179.459 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -55.32 -53.95 49.73 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.998 2.519 . . . . 0.0 112.685 170.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -55.51 -57.06 13.48 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.478 1.111 . . . . 0.0 113.153 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.39 -44.77 76.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.92 1.688 . . . . 0.0 114.769 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 35.43 65.81 1.76 Allowed Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.245 1.818 . . . . 0.0 114.93 -168.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.53 78.53 0.18 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.317 2.678 . . . . 0.0 113.196 168.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.61 27.54 66.34 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 126.362 1.934 . . . . 0.0 115.992 171.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 pp -106.35 158.16 17.08 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 117.318 2.34 . . . . 0.0 117.318 -155.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 135.87 40.02 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 127.691 2.396 . . . . 0.0 113.608 168.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -104.59 135.4 46.06 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.293 1.037 . . . . 0.0 111.437 176.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -104.89 135.65 45.84 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.354 1.862 . . . . 0.0 109.186 164.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -104.64 130.8 52.61 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 122.764 1.268 . . . . 0.0 110.513 170.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.54 151.28 49.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 129.741 3.216 . . . . 0.0 106.025 -172.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 33' ' ' PHE . 67.4 m . . . . . 0 C--N 1.318 -0.779 0 O-C-N 120.843 -1.16 . . . . 0.0 109.025 149.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.65 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 25.6 t -108.57 131.63 58.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.909 -160.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.7 mmt -104.7 124.23 49.01 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 169.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.16 134.79 55.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.4 135.81 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.503 -169.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.1 t -104.22 120.6 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.3 t -142.99 134.05 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.91 1.684 . . . . 0.0 108.863 -162.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 t70 56.66 -66.93 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 127.751 2.42 . . . . 0.0 113.854 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.68 19.26 0.06 OUTLIER Glycine 0 CA--C 1.54 1.618 0 C-N-CA 128.576 2.989 . . . . 0.0 111.942 174.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -126.62 176.33 7.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.959 2.504 . . . . 0.0 109.252 -170.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -130.67 134.67 47.13 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.996 0.919 . . . . 0.0 111.901 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -135.0 150.24 50.31 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.416 1.486 . . . . 0.0 111.177 -173.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.23 135.1 30.36 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.474 1.11 . . . . 0.0 111.019 -173.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.79 120.73 2.73 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.731 1.634 . . . . 0.0 111.048 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 p -104.96 104.69 14.48 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.421 1.088 . . . . 0.0 110.47 -176.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.56 135.72 8.03 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 115.044 0.778 . . . . 0.0 115.044 -166.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -62.27 -1.98 0.88 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 170.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -161.2 158.56 27.58 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.561 2.344 . . . . 0.0 108.963 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -55.56 -32.73 63.26 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 121.028 1.74 . . . . 0.0 114.943 170.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -5.32 5.19 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 121.629 2.013 . . . . 0.0 115.247 169.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.7 tp -117.85 -52.44 2.43 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.412 1.885 . . . . 0.0 110.53 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.3 -53.89 50.38 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.372 1.469 . . . . 0.0 112.501 173.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.555 ' HG2' HG13 ' A' ' 7' ' ' VAL . 4.3 ttmt -55.5 -47.79 75.65 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 117.462 -1.256 . . . . 0.0 112.294 168.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -48.51 74.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 120.474 1.488 . . . . 0.0 112.529 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.6 mmm-85 -54.96 -59.47 4.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 129.228 3.011 . . . . 0.0 113.291 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -50.2 70.41 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.924 0.89 . . . . 0.0 112.457 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.93 -52.3 63.39 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 126.245 1.818 . . . . 0.0 112.8 172.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -52.65 -50.47 63.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.941 1.696 . . . . 0.0 111.843 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.2 m -55.33 -55.08 35.66 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.646 1.178 . . . . 0.0 112.193 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.05 -61.12 2.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 112.224 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -44.64 -60.12 2.15 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.791 2.436 . . . . 0.0 111.49 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.29 -53.25 56.35 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 117.886 0.312 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.8 m -55.25 -73.83 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.264 4.9 m -55.66 -47.11 79.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 124.8 1.24 . . . . 0.0 114.081 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -57.15 -47.23 81.69 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -55.45 -38.37 68.94 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.665 1.12 . . . . 0.0 112.946 172.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.547 0.839 0 C-N-CA 125.001 1.32 . . . . 0.0 110.36 167.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo . . . . . 0 C--O 1.238 0.509 0 N-CA-C 114.355 0.867 . . . . 0.0 114.355 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 13.3 t -55.1 -48.76 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -43.35 75.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.04 1.336 . . . . 0.0 114.525 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.5 mt -55.89 -61.06 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.744 1.218 . . . . 0.0 111.517 168.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.258 0.0 OUTLIER -55.27 -37.85 67.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.787 0.803 . . . . 0.0 112.806 -179.194 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -55.4 -56.98 13.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.954 2.102 . . . . 0.0 113.263 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -55.3 -53.33 57.53 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.95 2.1 . . . . 0.0 112.508 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -40.95 72.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.588 2.755 . . . . 0.0 115.078 173.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.331 0.0 OUTLIER 5.42 80.81 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 129.337 3.055 . . . . 0.0 118.055 -168.371 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.05 -175.83 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 124.311 3.341 . . . . 0.0 114.995 163.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.03 83.03 0.07 OUTLIER Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.121 -0.987 . . . . 0.0 111.507 162.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.32 160.7 33.14 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -175.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -135.7 135.78 40.34 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.826 2.05 . . . . 0.0 113.438 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -104.53 135.55 45.73 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.805 1.242 . . . . 0.0 110.668 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -125.99 135.73 52.16 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.91 2.084 . . . . 0.0 109.985 -178.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -104.63 131.47 52.02 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.509 1.147 . . . . 0.0 111.332 -172.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -134.94 135.63 41.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 128.848 2.859 . . . . 0.0 107.342 -175.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 p . . . . . 0 C--N 1.319 -0.741 0 O-C-N 119.86 -1.775 . . . . 0.0 112.663 159.744 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 . . . . . 0 C--O 1.232 0.143 0 N-CA-C 105.315 -2.106 . . . . 0.0 105.315 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -122.57 115.79 47.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.14 -157.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 82.1 mmm -104.9 117.34 33.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.834 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p -104.88 135.52 46.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.778 177.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.12 135.55 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.673 -0.642 . . . . 0.0 110.207 -172.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.2 t -104.27 116.46 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 169.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 63.1 t -137.67 123.33 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.487 1.515 . . . . 0.0 108.46 -165.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.8 t70 63.88 -29.44 0.1 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 127.244 2.218 . . . . 0.0 116.2 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 139.93 -5.81 2.82 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.555 1.55 . . . . 0.0 113.056 -161.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -104.95 167.92 9.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.101 2.161 . . . . 0.0 110.117 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -134.55 139.11 45.15 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.754 0.822 . . . . 0.0 112.227 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -135.04 158.99 42.93 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.435 1.494 . . . . 0.0 112.161 -176.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -135.45 121.67 20.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.23 1.812 . . . . 0.0 108.983 171.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -114.79 105.25 1.48 Allowed Glycine 0 CA--C 1.52 0.364 0 C-N-CA 126.013 1.768 . . . . 0.0 109.644 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -105.28 104.36 14.08 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.76 0.791 . . . . 0.0 110.126 -170.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.11 136.37 8.38 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.966 1.746 . . . . 0.0 114.36 -169.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -48.35 -26.72 2.17 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.487 ' HB3' ' HE2' ' A' ' 52' ' ' LYS . 20.3 t-20 -150.36 166.29 30.49 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 125.775 1.63 . . . . 0.0 111.072 169.269 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -46.61 -46.84 19.94 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.355 1.434 . . . . 0.0 114.407 -175.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.487 ' HE2' ' HB3' ' A' ' 50' ' ' ASN . 0.0 OUTLIER -58.47 -5.81 0.59 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 116.096 1.887 . . . . 0.0 116.096 175.986 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.6 tp -120.11 -42.89 2.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.296 2.238 . . . . 0.0 110.869 173.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.43 -59.57 4.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.089 1.356 . . . . 0.0 112.507 171.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -55.46 -39.83 70.85 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-O 115.455 -2.212 . . . . 0.0 112.984 164.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.28 -52.1 64.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 123.37 2.805 . . . . 0.0 111.907 178.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.23 -54.29 45.28 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.503 1.921 . . . . 0.0 114.078 169.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -58.37 8.05 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.29 -51.93 13.63 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 125.034 1.334 . . . . 0.0 114.105 167.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -55.13 -51.37 66.64 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.226 1.41 . . . . 0.0 112.052 178.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.2 m -55.28 -53.06 60.82 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.705 1.202 . . . . 0.0 111.831 174.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -61.7 2.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.229 175.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.59 -60.11 2.14 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 127.3 2.24 . . . . 0.0 110.97 178.346 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.05 -52.4 63.31 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.212 0.205 . . . . 0.0 111.495 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 m -55.36 -69.02 0.15 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.297 32.8 m -55.39 -47.13 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -176.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -56.73 -38.53 72.5 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -55.93 -44.97 78.84 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.126 1.33 . . . . 0.0 111.659 171.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.257 3.5 pp . . . . . 0 CA--C 1.541 0.627 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 175.082 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo . . . . . 0 C--O 1.236 0.391 0 N-CA-C 114.752 1.02 . . . . 0.0 114.752 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.479 HG13 ' HG2' ' A' ' 55' ' ' LYS . 74.8 t -55.1 -48.06 76.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.464 0 CA-C-N 118.264 0.484 . . . . 0.0 109.729 176.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.47 -42.53 74.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.913 1.285 . . . . 0.0 114.112 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.425 ' H ' HG13 ' A' ' 9' ' ' ILE . 3.5 mt -55.98 -59.26 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.299 1.04 . . . . 0.0 113.091 167.086 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.27 0.0 OUTLIER -55.4 -37.5 67.67 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.348 0.659 . . . . 0.0 112.062 -179.308 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -55.35 -61.81 2.09 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.461 2.304 . . . . 0.0 112.67 164.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.52 -53.4 56.8 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.187 -0.945 . . . . 0.0 112.343 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.419 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 11.8 mt -56.92 -40.22 75.92 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 171.389 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.42 0.0 OUTLIER 0.91 73.52 0.04 OUTLIER Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 127.831 2.452 . . . . 0.0 117.032 -160.619 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.08 64.06 5.15 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 124.346 3.364 . . . . 0.0 113.864 -173.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.08 27.34 73.72 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.739 1.161 . . . . 0.0 114.843 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -91.66 167.82 11.93 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.749 1.619 . . . . 0.0 113.676 -171.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -135.22 136.47 41.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.456 1.502 . . . . 0.0 113.367 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -104.32 135.4 45.85 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.045 0.938 . . . . 0.0 110.827 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -123.81 120.6 33.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.679 1.992 . . . . 0.0 109.158 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -104.95 131.56 52.3 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.551 1.14 . . . . 0.0 111.787 -167.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.38 168.48 18.51 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 126.669 1.988 . . . . 0.0 106.629 -179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.1 p . . . . . 0 C--N 1.311 -1.066 0 O-C-N 119.594 -1.941 . . . . 0.0 111.426 -179.607 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 N--CA 1.462 0.147 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.49 129.29 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-O 122.931 1.348 . . . . 0.0 114.507 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.29 125.38 53.82 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 120.678 -1.264 . . . . 0.0 110.154 -176.362 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.5 p -114.5 142.74 46.01 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 124.351 1.061 . . . . 0.0 111.708 177.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.18 135.94 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 120.891 -1.131 . . . . 0.0 110.973 -175.389 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.18 118.28 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 170.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -132.92 -33.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -158.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -137.59 13.35 2.97 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 122.221 1.01 . . . . 0.0 113.484 -160.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.29 -11.25 31.44 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -153.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -105.15 164.29 11.93 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 128.219 2.608 . . . . 0.0 110.862 175.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -129.83 138.68 51.13 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.301 1.84 . . . . 0.0 109.811 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -132.51 152.94 51.39 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.658 1.583 . . . . 0.0 109.194 -174.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -140.68 135.27 31.47 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.236 1.014 . . . . 0.0 111.178 173.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.66 122.79 4.67 Favored Glycine 0 CA--C 1.523 0.566 0 C-N-CA 126.519 2.009 . . . . 0.0 111.284 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 t -104.91 119.69 39.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.78 0.832 . . . . 0.0 110.549 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.28 149.14 20.82 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 125.104 1.335 . . . . 0.0 116.06 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -48.98 -26.16 2.37 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 175.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -161.15 -176.27 5.35 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.11 1.764 . . . . 0.0 108.78 152.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 28.5 mtmm -45.76 -38.66 7.27 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.943 2.097 . . . . 0.0 115.33 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -16.13 4.38 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 173.184 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.4 tp -123.38 -40.41 2.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.149 2.18 . . . . 0.0 111.786 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.69 -57.64 11.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.103 1.361 . . . . 0.0 112.291 171.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.479 ' HG2' HG13 ' A' ' 7' ' ' VAL . 8.6 ttmt -55.14 -45.82 75.65 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-O 116.61 -1.662 . . . . 0.0 109.376 169.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.44 75.44 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 121.994 2.179 . . . . 0.0 113.441 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -55.51 -57.82 10.31 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.815 0.846 . . . . 0.0 112.858 170.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.36 -52.27 64.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.082 0.953 . . . . 0.0 112.164 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.06 -58.37 6.76 Favored 'General case' 0 C--O 1.215 -0.723 0 C-N-CA 128.247 2.619 . . . . 0.0 111.978 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.04 -47.43 74.79 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 120.133 1.333 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 m -55.29 -55.63 29.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.22 1.008 . . . . 0.0 112.141 175.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -53.28 58.02 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.809 1.244 . . . . 0.0 112.839 173.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.87 -61.66 1.85 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 128.055 2.542 . . . . 0.0 110.325 176.55 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.31 -46.29 72.79 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 122.93 0.492 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.4 m -55.14 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.552 0.741 . . . . 0.0 112.767 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.0 m -55.45 -40.0 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -176.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.419 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 4.7 m-30 -59.84 -43.76 94.44 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 113.959 172.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -35.37 65.92 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.258 1.39 . . . . 0.0 113.811 163.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 N--CA 1.481 1.099 0 CA-C-N 119.324 0.966 . . . . 0.0 113.334 170.668 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 N--CA 1.461 -0.415 0 N-CA-C 113.901 0.693 . . . . 0.0 113.901 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 55' ' ' LYS . 93.5 t -52.76 -55.01 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 122.664 1.221 . . . . 0.0 108.88 173.246 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.2 tpt -55.79 -51.49 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 10.4 pt -55.67 -47.71 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 166.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.283 0.0 OUTLIER -55.63 -43.1 75.85 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.996 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.08 -54.59 41.2 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 112.031 172.027 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.53 -64.14 0.94 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.428 1.891 . . . . 0.0 112.739 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.281 50.6 mt -56.08 -25.21 44.45 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 116.369 1.989 . . . . 0.0 116.369 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER 22.64 61.38 0.33 Allowed Pre-proline 0 N--CA 1.491 1.583 0 C-N-CA 129.038 2.935 . . . . 0.0 116.495 -178.264 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.44 39.59 0.42 Allowed 'Trans proline' 0 CA--C 1.555 1.56 1 C-N-CA 125.416 4.078 . . . . 0.0 117.169 -160.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.66 32.22 13.79 Favored Glycine 0 CA--C 1.534 1.256 0 O-C-N 120.266 -1.521 . . . . 0.0 113.737 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.31 171.58 7.29 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -169.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -135.33 140.25 44.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.621 2.369 . . . . 0.0 111.513 160.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.4 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 27.2 m-85 -104.42 135.43 45.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.415 1.086 . . . . 0.0 110.841 176.248 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -128.9 127.67 42.26 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.565 1.546 . . . . 0.0 109.409 176.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -105.35 131.24 53.04 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.506 1.122 . . . . 0.0 111.707 -170.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.23 170.16 15.84 Favored 'General case' 0 N--CA 1.44 -0.953 0 C-N-CA 127.917 2.487 . . . . 0.0 105.584 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--N 1.315 -0.934 0 O-C-N 119.533 -1.979 . . . . 0.0 110.56 174.717 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 . . . . . 0 N--CA 1.461 0.083 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.65 135.12 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-O 123.775 1.75 . . . . 0.0 114.77 -169.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.89 130.36 56.8 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.267 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 p -119.31 135.64 54.62 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.06 0.944 . . . . 0.0 111.437 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.4 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 2.3 m -122.15 135.69 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.01 0.924 . . . . 0.0 111.534 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.7 t -104.39 127.1 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 165.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.8 p -148.32 148.68 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.429 1.491 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 t70 60.19 -66.4 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 127.452 2.301 . . . . 0.0 114.258 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -173.01 19.14 0.06 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 128.245 2.831 . . . . 0.0 112.396 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -135.27 167.37 21.14 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.576 2.35 . . . . 0.0 111.66 -168.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -134.95 136.73 42.47 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.627 1.171 . . . . 0.0 112.391 -165.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -135.09 153.92 51.86 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.898 1.679 . . . . 0.0 110.936 -175.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -137.95 135.17 35.77 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.857 1.263 . . . . 0.0 111.889 -178.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.69 106.6 0.63 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 127.368 2.413 . . . . 0.0 111.464 -172.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 p -104.74 114.55 28.83 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.695 1.247 . . . . 0.0 110.72 -177.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.97 143.23 14.65 Favored Glycine 0 CA--C 1.528 0.881 0 CA-C-N 114.412 -1.267 . . . . 0.0 115.562 -170.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -30.05 -53.47 0.16 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 125.573 1.549 . . . . 0.0 114.546 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -137.94 -175.59 4.14 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.81 1.244 . . . . 0.0 110.593 159.007 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.458 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 95.4 mttt -45.28 -43.66 10.73 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.185 1.394 . . . . 0.0 114.479 177.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.04 -17.17 2.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 115.835 1.791 . . . . 0.0 115.835 177.244 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.4 tp -115.41 -38.48 3.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.196 1.798 . . . . 0.0 111.254 174.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.47 -54.62 41.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.514 1.126 . . . . 0.0 112.079 173.786 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.506 ' HB3' HG22 ' A' ' 7' ' ' VAL . 15.3 mmtt -55.19 -44.05 74.96 Favored 'General case' 0 C--O 1.204 -1.32 0 CA-C-O 114.91 -2.472 . . . . 0.0 112.457 162.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -47.69 75.28 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 124.324 3.238 . . . . 0.0 111.474 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -55.39 -62.85 1.4 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.452 1.901 . . . . 0.0 112.728 171.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.1 -55.72 27.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.262 1.425 . . . . 0.0 112.559 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -42.37 -63.92 0.68 Allowed 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 125.592 1.557 . . . . 0.0 114.21 165.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -45.32 75.76 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.832 1.651 . . . . 0.0 111.606 -176.093 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 m -55.23 -57.73 10.58 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.307 0.643 . . . . 0.0 112.296 175.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.489 ' O ' HG22 ' A' ' 66' ' ' VAL . . . -55.18 -50.87 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.287 1.035 . . . . 0.0 112.503 175.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -60.56 3.12 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.51 1.924 . . . . 0.0 111.164 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.39 -47.59 69.39 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.076 0.398 . . . . 0.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 37.6 m -55.35 -71.19 0.09 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 173.245 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.489 HG22 ' O ' ' A' ' 62' ' ' ALA . 18.9 m -55.22 -39.93 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.281 0.946 . . . . 0.0 113.43 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -56.32 -46.01 80.07 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.845 -1.159 . . . . 0.0 113.993 170.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -34.97 65.59 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 165.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 20.1 mt . . . . . 0 N--CA 1.483 1.191 0 CA-C-N 119.296 0.953 . . . . 0.0 112.73 170.552 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo . . . . . 0 C--O 1.238 0.478 0 N-CA-C 115.161 1.177 . . . . 0.0 115.161 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.5 t -52.08 -49.69 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.085 0.554 . . . . 0.0 109.616 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -55.56 -51.81 65.85 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 179.223 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.411 ' H ' HG13 ' A' ' 9' ' ' ILE . 5.0 mt -55.75 -51.19 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.643 1.11 . . . . 0.0 111.884 174.299 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.86 -51.44 63.61 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.561 1.144 . . . . 0.0 109.876 176.06 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -55.73 -52.37 64.16 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.127 1.771 . . . . 0.0 112.444 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -55.35 -60.08 3.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.044 2.138 . . . . 0.0 113.58 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.4 mt -55.89 -39.33 71.42 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 30.97 65.6 0.93 Allowed Pre-proline 0 N--CA 1.487 1.404 0 C-N-CA 128.048 2.539 . . . . 0.0 115.495 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -64.59 -34.05 53.59 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.144 2.563 . . . . 0.0 114.435 -167.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.99 25.05 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.693 1.616 . . . . 0.0 113.335 177.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.446 ' CD2' HG22 ' A' ' 39' ' ' VAL . 37.3 mt -58.92 136.27 57.82 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 126.58 1.952 . . . . 0.0 114.866 -165.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -135.08 135.93 41.63 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.629 1.572 . . . . 0.0 110.363 147.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.405 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 20.1 m-85 -104.67 135.28 46.36 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.664 1.228 . . . . 0.0 110.735 -178.276 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.68 135.59 55.08 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 128.017 2.527 . . . . 0.0 109.101 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -104.79 126.05 51.47 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 122.831 1.3 . . . . 0.0 111.618 -175.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.64 145.84 51.4 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 130.928 3.691 . . . . 0.0 105.631 -176.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.475 0.818 0 O-C-N 119.399 -2.063 . . . . 0.0 110.344 -172.448 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 21.4 m-30 . . . . . 0 N--CA 1.447 -0.602 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -108.58 116.38 51.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 113.493 -1.685 . . . . 0.0 107.406 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 11.8 mmt -104.71 123.8 48.25 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 m -123.13 135.06 54.19 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.405 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 1.8 m -127.91 135.43 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.054 0.942 . . . . 0.0 111.989 -169.2 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.7 t -104.36 125.26 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 167.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.446 HG22 ' CD2' ' A' ' 17' ' ' LEU . 94.3 t -135.36 -33.86 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -158.043 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -149.21 26.48 0.87 Allowed 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 122.408 1.099 . . . . 0.0 111.566 -160.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.23 -15.44 8.9 Favored Glycine 0 CA--C 1.538 1.474 0 O-C-N 120.797 -1.189 . . . . 0.0 112.873 -161.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -112.1 168.76 9.35 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.769 2.027 . . . . 0.0 112.252 175.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -133.48 140.23 47.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.585 1.954 . . . . 0.0 111.106 -163.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.97 155.25 51.07 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.945 1.698 . . . . 0.0 110.762 -175.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -132.74 135.08 45.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.285 1.034 . . . . 0.0 110.581 -176.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.01 109.24 0.85 Allowed Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.106 1.336 . . . . 0.0 112.522 -166.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.7 p -104.78 104.63 14.45 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.019 0.909 . . . . 0.0 112.245 -168.363 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.17 135.93 7.62 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 116.139 1.215 . . . . 0.0 116.139 -176.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -50.46 -23.8 2.69 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -149.34 176.94 10.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.268 1.027 . . . . 0.0 110.831 157.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -47.11 -48.35 22.99 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 125.897 1.679 . . . . 0.0 114.444 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.23 -9.41 0.65 Allowed 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 176.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.8 tp -117.56 -41.73 2.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.808 2.043 . . . . 0.0 110.798 172.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.63 -59.52 4.73 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.647 1.579 . . . . 0.0 113.036 173.267 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -55.46 -41.58 73.12 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 115.667 -2.111 . . . . 0.0 112.532 164.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -48.97 73.22 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 122.719 2.508 . . . . 0.0 111.19 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -55.32 -58.82 6.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.728 2.011 . . . . 0.0 115.343 163.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.38 -53.71 52.86 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.766 1.166 . . . . 0.0 111.889 -176.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -40.58 -72.84 0.06 Allowed 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 117.525 -1.226 . . . . 0.0 113.634 156.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -45.27 -46.32 12.56 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.175 1.807 . . . . 0.0 113.796 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.4 m -55.27 -63.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.881 1.272 . . . . 0.0 112.895 170.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.34 -59.58 4.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.078 0.951 . . . . 0.0 112.81 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -45.27 -63.34 0.96 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.779 3.231 . . . . 0.0 111.226 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.21 -45.02 75.9 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 175.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 85.5 m -55.33 -68.46 0.19 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.583 0.629 . . . . 0.0 112.359 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.4 m -55.29 -35.32 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.409 1.004 . . . . 0.0 113.125 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -63.73 -40.56 97.03 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.616 -1.303 . . . . 0.0 114.115 175.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -55.41 -39.32 70.07 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 118.926 0.785 . . . . 0.0 112.503 162.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 N--CA 1.483 1.213 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 170.198 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo . . . . . 0 CA--C 1.534 0.523 0 N-CA-C 114.962 1.101 . . . . 0.0 114.962 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.676 HG13 ' HG2' ' A' ' 55' ' ' LYS . 15.2 t -55.44 -52.98 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.666 1.121 . . . . 0.0 109.287 160.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.49 -48.93 73.81 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -176.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.4 pt -60.13 -49.68 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.586 1.085 . . . . 0.0 111.805 169.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.348 0.0 OUTLIER -55.94 -39.37 71.6 Favored 'General case' 0 N--CA 1.461 0.094 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 177.666 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -55.54 -60.2 3.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.619 1.968 . . . . 0.0 109.426 169.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -55.2 -59.2 5.11 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.438 1.495 . . . . 0.0 113.999 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.6 mt -55.73 -45.27 78.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.157 1.783 . . . . 0.0 115.619 171.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 34.83 65.85 1.58 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 127.051 2.14 . . . . 0.0 115.3 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.64 33.91 0.09 OUTLIER 'Trans proline' 0 CA--C 1.557 1.659 1 C-N-CA 125.814 4.342 . . . . 0.0 118.452 -175.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 10.93 85.36 Favored Glycine 0 CA--C 1.539 1.587 0 O-C-N 119.762 -1.836 . . . . 0.0 114.351 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.22 164.0 4.53 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.304 2.241 . . . . 0.0 115.337 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.07 139.49 44.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.79 2.036 . . . . 0.0 111.818 164.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -104.56 135.37 46.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.276 1.03 . . . . 0.0 112.376 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -118.71 135.17 54.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.498 2.319 . . . . 0.0 109.241 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -112.37 129.23 56.38 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 122.315 1.055 . . . . 0.0 112.146 -174.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.74 150.99 51.49 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 129.75 3.22 . . . . 0.0 108.392 -171.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 C--N 1.316 -0.862 0 C-N-CA 126.777 2.031 . . . . 0.0 113.977 -169.746 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.237 0.397 0 N-CA-C 102.654 -3.091 . . . . 0.0 102.654 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.1 t -124.1 130.03 73.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 123.197 1.475 . . . . 0.0 109.302 -157.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.5 mmm -118.29 135.34 54.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 113.52 -1.673 . . . . 0.0 108.799 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.5 m -125.19 135.46 52.62 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.508 0.723 . . . . 0.0 110.197 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.6 m -117.86 135.92 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.251 1.021 . . . . 0.0 111.992 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.5 t -104.2 126.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 164.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.7 p -151.66 149.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.693 1.197 . . . . 0.0 110.347 -178.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 55.8 -69.85 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.32 2.248 . . . . 0.0 114.112 -168.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.02 21.88 0.08 OUTLIER Glycine 0 CA--C 1.537 1.451 0 C-N-CA 128.396 2.903 . . . . 0.0 111.794 173.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -128.55 162.43 27.27 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.441 2.296 . . . . 0.0 109.878 -167.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -132.81 133.66 43.66 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.95 1.3 . . . . 0.0 111.626 -173.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -135.11 141.5 46.03 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.608 1.163 . . . . 0.0 110.741 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -118.16 135.04 54.48 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.337 1.855 . . . . 0.0 109.976 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.82 132.7 6.55 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.625 1.107 . . . . 0.0 112.556 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -128.03 104.65 7.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.748 0.785 . . . . 0.0 111.719 -164.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.96 140.56 11.68 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 125.49 1.519 . . . . 0.0 115.161 -163.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -47.37 -27.68 1.74 Allowed 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 116.074 1.879 . . . . 0.0 116.074 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -154.97 174.75 14.72 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 126.639 1.976 . . . . 0.0 109.498 162.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -53.11 -31.78 43.89 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 127.393 2.277 . . . . 0.0 115.982 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -13.9 7.78 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 121.226 1.83 . . . . 0.0 115.127 167.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.35 -50.79 2.72 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.209 2.204 . . . . 0.0 110.264 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -52.56 63.19 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.377 -1.452 . . . . 0.0 112.962 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.676 ' HG2' HG13 ' A' ' 7' ' ' VAL . 4.9 ttmt -55.14 -48.41 73.73 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-O 117.23 -1.367 . . . . 0.0 109.444 169.098 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.06 72.37 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 120.561 1.528 . . . . 0.0 113.675 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -55.31 -60.95 2.69 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.574 1.149 . . . . 0.0 112.178 172.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -50.87 68.51 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.252 1.021 . . . . 0.0 112.207 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.67 -66.98 0.29 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 126.517 1.927 . . . . 0.0 111.904 171.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -55.45 -38.49 69.12 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.257 0.935 . . . . 0.0 112.942 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 t -55.33 -59.72 4.41 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.872 0.869 . . . . 0.0 113.167 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.14 -56.39 20.43 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.122 1.369 . . . . 0.0 112.672 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.404 ' HG ' ' CZ ' ' A' ' 67' ' ' PHE . 0.6 OUTLIER -43.54 -61.49 1.37 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 111.458 172.622 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.24 -49.25 67.22 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.809 0.731 . . . . 0.0 111.165 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 35.9 m -55.29 -73.38 0.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 173.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.273 34.0 m -55.51 -44.39 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.404 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 7.6 m-30 -56.38 -48.88 75.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 171.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.86 -37.06 68.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 120.212 1.369 . . . . 0.0 113.696 169.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.551 1.015 0 C-N-CA 124.582 1.153 . . . . 0.0 111.655 168.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 C--O 1.236 0.391 0 CA-C-O 118.681 -0.633 . . . . 0.0 113.54 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.573 HG13 ' HG2' ' A' ' 55' ' ' LYS . 78.5 t -53.87 -51.76 41.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.03 -49.13 72.33 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -177.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.64 -58.18 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.218 1.007 . . . . 0.0 111.371 174.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.439 ' HB2' HD13 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -55.06 -46.36 75.37 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.453 1.101 . . . . 0.0 111.635 179.793 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -55.56 -57.29 12.54 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.271 1.828 . . . . 0.0 112.427 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -55.85 -53.16 60.08 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.708 1.603 . . . . 0.0 113.174 175.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.46 -34.97 64.98 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.069 1.348 . . . . 0.0 113.488 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 35.8 54.11 2.22 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 127.161 2.184 . . . . 0.0 115.245 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -73.21 58.53 3.6 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 124.71 3.607 . . . . 0.0 115.227 -167.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.42 17.89 78.0 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.513 1.53 . . . . 0.0 114.84 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -81.62 174.1 11.72 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -172.106 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -134.97 143.06 46.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 127.127 2.171 . . . . 0.0 110.309 157.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -104.32 129.64 52.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 124.664 1.228 . . . . 0.0 109.584 172.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.72 135.18 51.71 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 127.69 2.396 . . . . 0.0 108.482 177.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -109.77 125.63 52.9 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 123.144 1.45 . . . . 0.0 111.701 -176.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 mp -135.09 157.09 47.82 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 131.319 3.847 . . . . 0.0 105.826 -173.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 C--N 1.322 -0.611 0 O-C-N 119.317 -2.114 . . . . 0.0 110.144 169.648 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 . . . . . 0 N--CA 1.445 -0.684 0 N-CA-C 104.604 -2.369 . . . . 0.0 104.604 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -118.65 117.74 55.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 123.046 1.403 . . . . 0.0 110.561 -168.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.2 mmm -105.33 126.06 51.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.733 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.7 m -116.71 135.5 53.72 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 123.652 0.781 . . . . 0.0 110.125 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 m -119.48 135.91 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.954 0.902 . . . . 0.0 111.702 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 87.8 t -104.11 127.79 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 160.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.1 p -148.85 146.93 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.825 1.65 . . . . 0.0 109.321 -174.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.6 t70 59.07 -67.22 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.944 2.098 . . . . 0.0 114.668 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 19.47 0.07 OUTLIER Glycine 0 CA--C 1.541 1.719 0 C-N-CA 128.528 2.966 . . . . 0.0 112.798 169.595 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -135.12 165.04 26.3 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.721 2.408 . . . . 0.0 111.667 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -133.92 137.39 44.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.538 1.135 . . . . 0.0 112.779 -167.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -135.13 157.48 46.82 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.428 1.491 . . . . 0.0 111.812 -175.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -132.83 133.83 43.87 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.557 1.943 . . . . 0.0 109.268 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -131.4 113.54 1.38 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 125.036 1.303 . . . . 0.0 112.089 -175.447 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.5 p -104.99 108.96 20.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.289 1.035 . . . . 0.0 112.122 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.65 143.49 15.05 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.927 1.727 . . . . 0.0 114.466 -173.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -17.85 1.47 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 177.199 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -161.5 179.51 8.17 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.499 1.92 . . . . 0.0 110.308 153.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -45.45 -40.45 8.3 Favored 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.357 1.863 . . . . 0.0 115.766 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.01 -16.96 5.62 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 174.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -118.33 -44.24 2.68 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.886 2.074 . . . . 0.0 111.378 176.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.46 -53.26 58.53 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.582 -1.324 . . . . 0.0 112.77 175.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.573 ' HG2' HG13 ' A' ' 7' ' ' VAL . 8.2 ttmt -55.24 -46.25 76.04 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-O 116.53 -1.7 . . . . 0.0 110.967 166.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.05 75.06 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 121.972 2.169 . . . . 0.0 112.578 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -55.48 -60.25 3.69 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.522 1.929 . . . . 0.0 112.163 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.24 -50.66 68.89 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.428 1.091 . . . . 0.0 112.322 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.5 -59.64 3.57 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.239 1.816 . . . . 0.0 111.618 170.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -48.35 72.77 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 120.104 1.32 . . . . 0.0 110.691 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -55.36 -60.33 3.55 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 173.479 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.37 -61.55 2.26 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 126.493 1.917 . . . . 0.0 112.307 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.439 HD13 ' HB2' ' A' ' 10' ' ' LEU . 11.7 tp -53.29 -53.26 53.46 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.647 2.379 . . . . 0.0 111.922 -177.539 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.33 74.42 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.052 0.842 . . . . 0.0 112.802 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 95.6 m -55.28 -62.55 1.6 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.6 0.76 . . . . 0.0 112.984 175.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 m -55.58 -46.29 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.95 -47.45 77.58 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.83 -38.93 70.69 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.719 1.208 . . . . 0.0 114.248 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.551 0.995 0 C-N-CA 124.993 1.317 . . . . 0.0 111.803 167.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo . . . . . 0 CA--C 1.532 0.415 0 N-CA-C 115.12 1.161 . . . . 0.0 115.12 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.502 HG13 ' HG2' ' A' ' 55' ' ' LYS . 42.6 t -55.18 -44.77 76.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 CA-C-N 118.85 0.75 . . . . 0.0 110.548 168.372 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.32 -42.64 74.02 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.854 -1.154 . . . . 0.0 113.019 177.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.6 mt -60.22 -57.39 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.648 1.179 . . . . 0.0 110.684 173.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.315 0.0 OUTLIER -55.84 -38.9 70.68 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 115.645 1.721 . . . . 0.0 115.645 176.291 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -56.13 -52.86 62.83 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 124.848 1.259 . . . . 0.0 111.559 171.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.26 -65.62 0.55 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.705 1.602 . . . . 0.0 113.175 173.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.8 mt -55.57 -43.41 75.88 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.636 1.574 . . . . 0.0 115.234 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.263 7.7 ptm85 30.24 66.89 0.79 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 128.299 2.64 . . . . 0.0 115.246 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -61.02 20.17 0.04 OUTLIER 'Trans proline' 0 CA--C 1.552 1.392 1 C-N-CA 125.777 4.318 . . . . 0.0 118.348 -175.284 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.19 30.36 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.123 1.345 . . . . 0.0 113.698 -175.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 pp -88.7 159.67 17.71 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -176.223 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.46 138.42 43.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.212 1.805 . . . . 0.0 112.493 -179.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -104.67 135.13 46.64 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.431 1.11 . . . . 0.0 112.85 -171.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -105.28 135.32 46.86 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.018 2.527 . . . . 0.0 108.843 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -108.35 121.11 44.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.114 0.959 . . . . 0.0 110.958 175.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.6 155.97 43.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 129.453 3.101 . . . . 0.0 107.123 -175.473 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.7 t . . . . . 0 C--N 1.321 -0.67 0 O-C-N 120.451 -1.405 . . . . 0.0 110.857 160.121 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 . . . . . 0 CA--C 1.519 -0.244 0 N-CA-C 105.915 -1.884 . . . . 0.0 105.915 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.3 t -112.84 117.5 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 122.038 0.923 . . . . 0.0 109.208 -169.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 78.9 mmm -104.77 135.04 46.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 173.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.2 m -132.81 135.47 45.69 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 122.47 0.308 . . . . 0.0 111.055 -176.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.11 135.51 60.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.303 1.041 . . . . 0.0 112.191 -173.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.6 t -104.47 120.11 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 167.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 78.2 t -125.04 -45.44 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -157.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -148.27 29.98 0.86 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 122.669 1.223 . . . . 0.0 111.066 -162.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.94 -12.71 22.47 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 120.532 -1.355 . . . . 0.0 112.963 -162.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -109.96 161.78 15.16 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 126.688 1.995 . . . . 0.0 111.735 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -134.85 137.96 43.75 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.039 1.736 . . . . 0.0 111.389 -162.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -134.97 149.94 50.29 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.373 1.469 . . . . 0.0 111.088 -175.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -132.9 135.04 45.34 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.274 1.43 . . . . 0.0 110.399 -174.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.83 117.41 1.75 Allowed Glycine 0 CA--C 1.523 0.557 0 C-N-CA 125.238 1.399 . . . . 0.0 112.707 -167.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 p -106.64 104.73 14.49 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.736 1.214 . . . . 0.0 112.26 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 147.73 19.33 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.633 1.587 . . . . 0.0 114.795 -173.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -44.24 -39.32 4.37 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -155.2 177.42 11.36 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.777 1.631 . . . . 0.0 110.333 165.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -45.23 -41.39 8.37 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 127.422 2.289 . . . . 0.0 116.159 -174.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 -13.87 1.74 Allowed 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.5 tp -125.98 -42.71 1.87 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.439 2.295 . . . . 0.0 111.505 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.72 40.49 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.443 -1.411 . . . . 0.0 112.333 172.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.502 ' HG2' HG13 ' A' ' 7' ' ' VAL . 11.2 ttmt -55.41 -39.77 70.62 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 117.419 -1.277 . . . . 0.0 111.932 168.665 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.39 -54.83 38.82 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.576 1.535 . . . . 0.0 111.667 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -54.99 -52.79 62.02 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.638 1.975 . . . . 0.0 113.661 171.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -52.62 63.11 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.622 0.769 . . . . 0.0 112.126 177.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.18 -53.65 47.51 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 125.854 1.662 . . . . 0.0 112.202 171.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -52.49 -50.4 62.81 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.634 1.574 . . . . 0.0 111.876 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.8 t -55.3 -56.45 19.91 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 113.034 171.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -61.45 2.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.771 1.229 . . . . 0.0 112.718 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.44 ' HG ' ' CE2' ' A' ' 67' ' ' PHE . 0.4 OUTLIER -46.23 -57.78 4.25 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 128.566 2.746 . . . . 0.0 111.5 176.881 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.89 -49.88 70.14 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.528 0.604 . . . . 0.0 111.103 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 50.2 m -55.24 -73.97 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 173.261 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.288 18.3 m -55.72 -44.62 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -175.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.44 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 6.6 m-30 -60.06 -44.54 94.65 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.652 -1.28 . . . . 0.0 114.149 172.365 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.83 -37.6 68.9 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.384 1.447 . . . . 0.0 114.439 168.199 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.548 0.902 0 C-N-CA 124.851 1.26 . . . . 0.0 111.594 167.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo . . . . . 0 N--CA 1.461 -0.433 0 N-CA-C 114.942 1.093 . . . . 0.0 114.942 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.535 HG22 ' HB3' ' A' ' 55' ' ' LYS . 90.0 t -55.04 -52.9 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 173.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -55.45 -54.77 39.68 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 127.154 2.181 . . . . 0.0 115.558 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.276 1.7 pt -59.95 -50.38 80.34 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-O 118.115 -0.945 . . . . 0.0 113.085 172.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.307 0.0 OUTLIER -55.52 -46.24 77.05 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.462 1.483 . . . . 0.0 113.521 178.692 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -46.96 -63.07 1.13 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.247 2.219 . . . . 0.0 111.809 168.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -56.28 -47.02 79.45 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 176.032 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.5 mt -55.67 -29.16 58.86 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.909 1.283 . . . . 0.0 114.342 171.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 35.36 60.41 2.62 Favored Pre-proline 0 N--CA 1.486 1.362 0 C-N-CA 126.782 2.033 . . . . 0.0 116.238 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -59.42 21.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.56 1.786 0 C-N-CA 125.244 3.963 . . . . 0.0 119.58 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.23 24.72 76.69 Favored Glycine 0 CA--C 1.536 1.391 0 O-C-N 119.856 -1.777 . . . . 0.0 112.775 -167.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.42 171.96 7.89 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.918 2.087 . . . . 0.0 115.032 -172.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.35 135.25 40.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.091 1.357 . . . . 0.0 111.942 158.426 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -104.68 135.63 45.71 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.235 1.414 . . . . 0.0 110.549 173.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -130.31 135.16 47.78 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.418 1.487 . . . . 0.0 109.906 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -107.98 128.56 54.76 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.578 1.18 . . . . 0.0 112.214 -168.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.8 151.49 52.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 129.839 3.256 . . . . 0.0 106.702 -172.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p . . . . . 0 C--N 1.322 -0.63 0 O-C-N 119.933 -1.73 . . . . 0.0 110.127 161.2 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 . . . . . 0 CA--C 1.512 -0.517 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.4 t -109.89 124.24 66.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.021 -1.445 . . . . 0.0 109.89 -169.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 63.1 mmm -104.86 124.36 49.31 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -111.38 134.02 53.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.513 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.64 135.58 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.469 0.708 . . . . 0.0 111.571 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -104.47 119.79 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 166.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.7 m -133.65 -3.03 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 -160.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -155.43 -20.11 0.11 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 -174.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.31 -18.33 28.06 Favored Glycine 0 CA--C 1.538 1.48 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -142.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -105.0 162.17 13.58 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.701 1.6 . . . . 0.0 110.841 170.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -133.68 140.05 46.81 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.254 1.822 . . . . 0.0 110.925 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.03 159.56 41.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.103 1.361 . . . . 0.0 111.532 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -135.6 134.66 39.54 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.361 1.864 . . . . 0.0 109.411 176.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.1 120.71 2.83 Favored Glycine 0 CA--C 1.523 0.551 0 C-N-CA 125.158 1.361 . . . . 0.0 111.338 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.4 p -105.01 110.47 22.88 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.648 1.179 . . . . 0.0 111.708 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.47 155.75 22.35 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.867 1.698 . . . . 0.0 114.465 -168.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -55.06 -38.74 68.41 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.801 -0.823 . . . . 0.0 113.148 174.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -151.17 -177.44 6.04 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.794 1.638 . . . . 0.0 109.193 159.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.5 mtmm -44.22 -35.04 2.08 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 127.683 2.393 . . . . 0.0 115.082 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.2 pttt -46.34 -29.91 1.87 Allowed 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.5 tp -121.3 -40.7 2.56 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.193 2.197 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.55 -52.03 65.08 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.904 1.282 . . . . 0.0 112.664 173.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.535 ' HB3' HG22 ' A' ' 7' ' ' VAL . 5.4 ttmt -55.38 -47.93 75.07 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 117.398 -1.286 . . . . 0.0 110.866 166.172 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.8 73.7 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 120.471 1.487 . . . . 0.0 112.686 -176.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.4 mmm-85 -55.03 -59.77 4.3 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.885 2.874 . . . . 0.0 113.305 169.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -49.42 72.57 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.594 0.712 . . . . 0.0 112.506 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.98 -51.49 66.04 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 126.646 1.978 . . . . 0.0 112.111 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -54.94 -47.6 74.25 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.409 1.484 . . . . 0.0 111.904 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.33 -54.97 36.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.577 1.151 . . . . 0.0 112.774 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.1 -57.94 9.71 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.98 -55.06 13.05 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 128.371 2.668 . . . . 0.0 111.61 176.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.11 68.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.504 0.593 . . . . 0.0 110.92 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 27.1 m -55.47 -74.67 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 172.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.1 m -55.56 -37.28 45.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.26 4.8 m-30 -68.47 -33.61 74.48 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 171.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -55.51 -35.26 65.41 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.152 -1.592 . . . . 0.0 113.156 159.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.5 mt . . . . . 0 N--CA 1.479 0.976 0 CA-C-O 118.248 -0.882 . . . . 0.0 112.429 169.898 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 N--CA 1.46 -0.499 0 CA-C-O 118.148 -0.855 . . . . 0.0 113.786 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.602 HG13 ' HG2' ' A' ' 55' ' ' LYS . 97.0 t -54.99 -53.24 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 171.067 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.55 -55.47 31.59 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.271 7.3 pt -58.42 -47.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 120.735 1.607 . . . . 0.0 114.399 174.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 7' ' ' VAL 0.275 0.0 OUTLIER -55.58 -46.65 77.22 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 174.676 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -55.2 -54.69 40.16 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.464 1.905 . . . . 0.0 112.324 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -55.4 -61.1 2.56 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.548 1.939 . . . . 0.0 113.259 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.432 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 8.3 mt -55.62 -34.91 65.32 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 175.837 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 36.76 58.57 3.64 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 127.127 2.171 . . . . 0.0 114.598 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.62 65.61 1.2 Allowed 'Trans proline' 0 CA--C 1.551 1.366 0 C-N-CA 124.52 3.48 . . . . 0.0 115.253 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.58 29.48 75.26 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.787 1.661 . . . . 0.0 114.835 172.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.3 pp -105.21 166.27 10.52 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 -163.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.31 145.63 47.67 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.733 2.013 . . . . 0.0 111.886 166.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -104.56 128.92 52.66 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.686 0.795 . . . . 0.0 110.471 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -104.89 134.34 48.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.227 1.811 . . . . 0.0 109.258 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.445 ' CE1' ' HE3' ' A' ' 51' ' ' LYS . 62.9 t80 -113.17 126.11 55.08 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.784 1.278 . . . . 0.0 110.969 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.93 154.92 47.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 130.065 3.346 . . . . 0.0 106.024 -173.445 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.5 t . . . . . 0 C--N 1.321 -0.641 0 O-C-N 119.577 -1.952 . . . . 0.0 110.133 164.578 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 . . . . . 0 N--CA 1.442 -0.827 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.4 t -112.99 127.21 70.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 123.287 1.518 . . . . 0.0 110.22 -170.044 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.75 135.12 46.72 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.961 -1.472 . . . . 0.0 107.571 171.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -122.67 135.31 54.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 122.739 0.416 . . . . 0.0 110.582 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.88 135.78 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.555 -0.716 . . . . 0.0 111.529 172.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.8 t -101.09 122.07 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 160.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.97 142.75 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 127.015 2.126 . . . . 0.0 108.881 -167.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.8 t70 58.32 -67.04 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.428 1.891 . . . . 0.0 114.172 -174.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -170.11 17.97 0.07 OUTLIER Glycine 0 CA--C 1.541 1.706 0 C-N-CA 128.539 2.971 . . . . 0.0 112.827 169.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -134.96 165.81 24.48 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.767 2.427 . . . . 0.0 111.73 -168.182 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -134.86 128.61 32.98 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.467 1.107 . . . . 0.0 112.222 -162.26 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.37 136.59 43.48 Favored 'General case' 0 C--O 1.206 -1.218 0 C-N-CA 124.923 1.289 . . . . 0.0 111.956 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -104.44 134.51 47.52 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 126.719 2.008 . . . . 0.0 109.85 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.69 112.67 1.16 Allowed Glycine 0 CA--C 1.52 0.367 0 C-N-CA 124.796 1.189 . . . . 0.0 112.202 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 p -104.8 117.18 33.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.671 0.788 . . . . 0.0 111.867 -172.494 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.52 146.49 18.5 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 125.158 1.361 . . . . 0.0 115.489 -166.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.42 -36.04 6.13 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 168.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -157.52 178.18 10.58 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.792 2.037 . . . . 0.0 109.066 162.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.445 ' HE3' ' CE1' ' A' ' 21' ' ' PHE . 82.0 mttt -46.44 -36.4 6.54 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 126.676 1.99 . . . . 0.0 115.162 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -16.14 2.42 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.249 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.3 tp -123.31 -43.29 2.2 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.7 2.0 . . . . 0.0 110.724 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.5 -52.43 63.7 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.554 -1.341 . . . . 0.0 112.279 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.602 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.4 ttmt -55.41 -47.28 76.16 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 117.529 -1.224 . . . . 0.0 110.677 169.026 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.49 -47.68 75.8 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 120.273 1.397 . . . . 0.0 112.615 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -55.48 -59.66 4.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.738 2.015 . . . . 0.0 112.03 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.35 -49.84 71.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.39 1.076 . . . . 0.0 112.092 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.23 -58.62 6.43 Favored 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 126.344 1.858 . . . . 0.0 112.406 173.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -55.31 -44.86 76.17 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.442 1.474 . . . . 0.0 111.689 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.6 m -55.26 -55.31 32.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.87 0.868 . . . . 0.0 112.505 173.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.24 -56.24 22.26 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.739 1.215 . . . . 0.0 112.329 174.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.41 -56.87 6.08 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 128.047 2.539 . . . . 0.0 111.183 176.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.15 -52.69 60.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.298 0.499 . . . . 0.0 110.762 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -71.2 0.09 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 175.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.289 24.7 m -55.26 -51.32 56.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 O-C-N 121.058 -1.026 . . . . 0.0 112.587 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.432 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 5.9 m-30 -55.79 -33.93 64.84 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 121.366 1.894 . . . . 0.0 114.777 174.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -55.72 -38.12 69.32 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 162.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.9 mt . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 162.906 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo . . . . . 0 C--O 1.237 0.432 0 N-CA-C 113.825 0.663 . . . . 0.0 113.825 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.7 t -54.24 -50.93 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -55.71 28.44 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.09 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.0 pt -55.58 -49.2 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.821 1.191 . . . . 0.0 113.671 172.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.445 ' HA ' HD13 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -54.56 -51.26 65.81 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.51 1.05 . . . . 0.0 112.047 177.131 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -55.63 -54.01 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.207 1.803 . . . . 0.0 112.72 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -59.99 -45.03 94.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -39.56 71.33 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.963 1.305 . . . . 0.0 113.359 171.019 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 30.85 61.11 1.05 Allowed Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 127.826 2.45 . . . . 0.0 116.241 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -53.63 -38.83 84.49 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.513 2.142 . . . . 0.0 114.918 -174.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.36 33.92 0.12 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.411 1.481 . . . . 0.0 112.258 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.446 HD13 ' CE1' ' A' ' 19' ' ' TYR . 1.4 pp -77.61 151.58 34.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 117.046 2.239 . . . . 0.0 117.046 -154.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 135.8 40.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.203 2.201 . . . . 0.0 112.606 157.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.635 ' CD2' ' HE3' ' A' ' 55' ' ' LYS . 65.3 m-85 -104.86 135.58 45.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.822 1.249 . . . . 0.0 112.913 -177.501 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -108.12 135.73 48.98 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 128.664 2.785 . . . . 0.0 110.91 173.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -104.97 126.57 52.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.558 1.143 . . . . 0.0 111.452 171.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.7 mp -135.05 144.28 47.18 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 129.475 3.11 . . . . 0.0 106.903 -173.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p . . . . . 0 N--CA 1.477 0.892 0 O-C-N 119.31 -2.119 . . . . 0.0 111.293 149.142 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 104.146 -2.539 . . . . 0.0 104.146 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.7 t -112.98 116.55 52.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 123.103 1.43 . . . . 0.0 109.063 -161.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.8 mmt -105.14 122.94 46.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.478 -1.237 . . . . 0.0 107.859 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -128.5 135.24 49.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -172.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.2 t -135.03 135.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 120.839 -1.163 . . . . 0.0 109.724 -163.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.7 t -104.1 104.73 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 103.061 -2.941 . . . . 0.0 103.061 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.8 p -100.84 -12.39 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -152.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -167.72 -37.38 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.258 2.223 . . . . 0.0 111.643 -158.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 150.78 -25.06 1.04 Allowed Glycine 0 CA--C 1.538 1.515 0 C-N-CA 125.872 1.701 . . . . 0.0 110.72 -161.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.85 163.0 13.07 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 125.26 1.424 . . . . 0.0 110.372 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.81 138.67 53.85 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.71 1.604 . . . . 0.0 112.079 -168.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -135.11 157.67 46.34 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.166 1.786 . . . . 0.0 111.844 -172.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -139.54 133.48 30.86 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.442 1.497 . . . . 0.0 110.384 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.96 119.58 2.17 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.471 1.51 . . . . 0.0 112.305 -173.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.2 p -105.24 104.96 14.79 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.409 1.084 . . . . 0.0 112.413 -171.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.87 138.03 9.6 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 125.115 1.34 . . . . 0.0 115.766 -176.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -57.66 -12.92 3.24 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -155.5 177.85 10.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.527 1.131 . . . . 0.0 111.231 155.317 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -49.75 -51.76 36.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 124.834 1.253 . . . . 0.0 113.818 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -6.76 0.44 Allowed 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 177.299 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.3 tp -115.26 -44.74 2.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.712 1.605 . . . . 0.0 110.308 171.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.56 -59.2 5.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.876 1.271 . . . . 0.0 113.086 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.635 ' HE3' ' CD2' ' A' ' 19' ' ' TYR . 18.8 mmtm -55.45 -37.81 68.21 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 115.288 -2.291 . . . . 0.0 112.581 164.771 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.72 -54.67 41.43 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 123.355 2.798 . . . . 0.0 111.492 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.33 -55.43 31.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 129.089 2.956 . . . . 0.0 113.749 170.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.41 -56.62 17.99 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 111.462 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . 0.42 ' CB ' ' HG ' ' A' ' 10' ' ' LEU . . . -44.97 -62.04 1.39 Allowed 'General case' 0 C--O 1.215 -0.749 0 C-N-CA 124.084 0.953 . . . . 0.0 113.161 166.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -47.53 -53.19 15.07 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.413 1.485 . . . . 0.0 112.015 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 25.1 p -55.4 -57.57 11.33 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 173.09 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.32 -64.25 0.9 Allowed 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 126.635 1.974 . . . . 0.0 112.014 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.445 HD13 ' HA ' ' A' ' 10' ' ' LEU . 11.9 tp -50.43 -54.45 21.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.677 2.791 . . . . 0.0 111.988 -179.101 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.17 -49.39 71.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.504 0.593 . . . . 0.0 112.388 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.3 m -55.43 -60.99 2.64 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 175.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 4.8 m -55.26 -47.56 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.275 0.943 . . . . 0.0 112.707 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.85 -47.05 77.97 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -55.49 -39.72 70.79 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.732 1.213 . . . . 0.0 112.541 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.55 0.949 0 C-N-CA 124.813 1.245 . . . . 0.0 110.374 166.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo . . . . . 0 N--CA 1.488 1.175 0 N-CA-C 112.561 0.177 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.2 m -158.33 156.41 30.53 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.747 1.619 . . . . 0.0 110.708 172.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 75.97 -45.71 1.99 Allowed Glycine 0 CA--C 1.538 1.473 0 C-N-CA 125.685 1.612 . . . . 0.0 114.554 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.46 170.92 14.82 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.845 2.058 . . . . 0.0 110.994 177.022 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -54.82 138.67 63.07 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 123.214 0.605 . . . . 0.0 109.858 158.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -63.66 -29.7 69.61 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.896 2.397 . . . . 0.0 114.862 -172.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.559 HG13 ' HG2' ' A' ' 55' ' ' LYS . 71.8 t -55.09 -51.53 53.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.33 -44.26 75.69 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.072 1.349 . . . . 0.0 114.386 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mt -58.23 -57.76 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 123.829 0.851 . . . . 0.0 112.148 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -55.32 -38.54 68.84 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.601 0.715 . . . . 0.0 112.304 178.947 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -55.08 -61.31 2.4 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.152 1.781 . . . . 0.0 111.928 168.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -55.57 -56.47 19.99 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.05 -1.031 . . . . 0.0 113.179 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.6 mt -55.93 -29.16 59.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 117.504 2.409 . . . . 0.0 117.504 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.325 0.0 OUTLIER -9.21 75.92 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.757 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 -167.695 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -58.04 -34.55 98.55 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 122.022 1.815 . . . . 0.0 116.196 -165.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 177.55 30.12 0.04 OUTLIER Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.228 1.394 . . . . 0.0 112.123 172.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -96.51 164.14 12.74 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -161.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.12 141.28 45.96 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.634 1.574 . . . . 0.0 112.535 173.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -104.55 135.23 46.34 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.623 1.169 . . . . 0.0 111.764 -177.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -104.82 135.25 46.53 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.106 1.362 . . . . 0.0 109.685 164.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -104.43 119.94 40.1 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.103 0.954 . . . . 0.0 109.016 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 136.02 54.57 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 128.846 2.859 . . . . 0.0 106.57 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t -85.41 159.94 19.87 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 119.463 -2.023 . . . . 0.0 109.756 154.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.316 26.4 mm-40 100.04 80.34 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.072 1.749 . . . . 0.0 114.962 158.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.7 t -121.12 5.86 10.31 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.684 148.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 50.62 -159.11 1.74 Allowed Glycine 0 CA--C 1.539 1.554 0 C-N-CA 126.317 1.913 . . . . 0.0 114.812 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.82 163.34 4.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 128.739 2.815 . . . . 0.0 113.545 -10.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.3 m -70.05 18.92 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 115.585 1.698 . . . . 0.0 115.585 -175.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -130.34 -38.4 1.37 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.475 1.11 . . . . 0.0 113.95 -163.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.18 -6.2 3.86 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.844 1.258 . . . . 0.0 113.274 169.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 47.7 tptt 84.73 149.14 0.07 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 128.245 2.618 . . . . 0.0 114.306 150.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.6 m -129.6 135.2 48.27 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 123.486 1.612 . . . . 0.0 112.247 161.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -104.63 135.63 45.68 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 129.542 3.137 . . . . 0.0 104.12 173.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.92 130.09 71.19 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 122.711 1.243 . . . . 0.0 109.875 -167.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 5.4 mmt -115.09 123.87 50.11 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.532 0.733 . . . . 0.0 110.333 177.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.88 136.58 44.11 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.931 0.892 . . . . 0.0 110.443 172.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.4 m -121.98 135.87 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.114 0.566 . . . . 0.0 112.397 167.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.9 t -104.47 128.54 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 161.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.436 HG13 ' H ' ' A' ' 40' ' ' ASP 0.305 7.7 p -126.74 -110.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 124.626 1.17 . . . . 0.0 111.508 -179.373 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.436 ' H ' HG13 ' A' ' 39' ' ' VAL . 25.4 t0 -81.14 45.22 0.82 Allowed 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 121.189 1.813 . . . . 0.0 114.025 -168.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.4 13.99 80.89 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.935 -1.103 . . . . 0.0 112.07 -166.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -119.09 153.1 35.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 127.013 2.125 . . . . 0.0 109.981 -171.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -134.01 134.63 42.67 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.489 1.116 . . . . 0.0 111.712 -174.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -135.24 154.65 51.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.062 1.345 . . . . 0.0 111.287 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -134.74 134.81 41.4 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.133 2.173 . . . . 0.0 108.573 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.04 122.19 2.78 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 124.828 1.204 . . . . 0.0 111.901 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.6 p -105.68 114.55 28.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.554 1.142 . . . . 0.0 111.511 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.57 145.28 17.3 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.686 1.136 . . . . 0.0 115.818 -175.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.47 -24.13 0.47 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 172.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -158.25 177.67 11.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.91 1.684 . . . . 0.0 109.699 156.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.406 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 28.4 mtmm -49.28 -36.2 19.99 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 126.545 1.938 . . . . 0.0 115.149 177.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -13.08 1.26 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 170.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.6 tp -125.53 -42.71 1.93 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.884 2.074 . . . . 0.0 110.862 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.406 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.45 -54.62 41.53 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.584 -1.322 . . . . 0.0 111.61 173.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.559 ' HG2' HG13 ' A' ' 7' ' ' VAL . 9.4 ttmt -55.48 -42.5 74.45 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.071 -1.442 . . . . 0.0 111.676 167.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.34 -51.42 66.81 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 121.238 1.836 . . . . 0.0 112.838 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -55.25 -56.33 21.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 129.495 3.118 . . . . 0.0 112.493 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.22 -53.54 54.79 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.836 1.254 . . . . 0.0 112.577 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.48 -56.46 9.69 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 126.409 1.884 . . . . 0.0 112.037 170.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -53.81 -48.0 70.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.697 1.599 . . . . 0.0 112.452 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.1 m -55.29 -57.92 9.84 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.581 1.152 . . . . 0.0 112.743 172.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -58.22 8.58 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.63 1.172 . . . . 0.0 111.762 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.417 ' HG ' ' CE2' ' A' ' 67' ' ' PHE . 0.5 OUTLIER -40.23 -59.43 1.28 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.416 2.687 . . . . 0.0 110.86 173.529 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.81 -56.66 15.52 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.174 0.443 . . . . 0.0 111.489 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 93.0 m -55.25 -70.35 0.11 Allowed 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 176.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.259 12.0 m -55.46 -40.85 60.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.417 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 6.8 m-30 -60.46 -40.24 90.47 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.166 -1.584 . . . . 0.0 114.212 170.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -35.14 65.23 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.262 1.392 . . . . 0.0 114.456 162.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt -71.96 -16.47 62.09 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.829 0.741 . . . . 0.0 112.999 169.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.1 m-70 66.42 41.62 3.2 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 127.802 2.441 . . . . 0.0 111.761 -174.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--O 1.253 1.241 0 C-N-CA 126.908 2.083 . . . . 0.0 111.297 -168.014 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 CA--C 1.538 0.716 0 N-CA-C 112.649 0.211 . . . . 0.0 112.649 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 m -67.99 29.97 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 127.996 2.518 . . . . 0.0 116.806 -168.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 64.65 20.49 66.12 Favored Glycine 0 CA--C 1.538 1.516 0 O-C-N 120.38 -1.45 . . . . 0.0 112.918 -165.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.0 tttt -59.38 133.74 56.37 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 127.172 2.189 . . . . 0.0 112.608 -168.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -133.71 175.4 3.71 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 126.783 2.033 . . . . 0.0 109.242 -179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.5 -38.66 32.01 Favored 'Trans proline' 0 C--N 1.347 0.494 0 CA-C-N 121.539 1.586 . . . . 0.0 113.933 -173.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.501 HG13 ' HG2' ' A' ' 55' ' ' LYS . 86.4 t -55.18 -49.34 72.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 173.056 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -46.85 75.98 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.0 mt -55.85 -56.17 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 119.611 1.096 . . . . 0.0 111.212 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.507 HD21 ' HE2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -54.83 -43.73 73.26 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.127 0.971 . . . . 0.0 112.719 -179.672 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -56.22 -58.02 9.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 127.006 2.122 . . . . 0.0 112.501 172.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -55.21 -55.02 36.04 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.81 2.044 . . . . 0.0 112.359 177.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mt -55.97 -38.15 70.01 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 171.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.288 0.0 OUTLIER 24.11 65.39 0.4 Allowed Pre-proline 0 N--CA 1.488 1.459 0 C-N-CA 127.399 2.28 . . . . 0.0 115.156 -168.724 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.53 55.93 3.83 Favored 'Trans proline' 0 CA--C 1.549 1.249 0 C-N-CA 124.811 3.674 . . . . 0.0 113.566 -173.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 63.19 24.27 67.05 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 125.8 1.666 . . . . 0.0 115.431 173.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.486 HD21 ' CD2' ' A' ' 10' ' ' LEU . 3.1 pp -90.62 173.3 8.12 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.494 1.147 . . . . 0.0 112.998 -172.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -133.26 134.93 44.58 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.823 0.849 . . . . 0.0 111.19 169.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.507 ' HE2' HD21 ' A' ' 10' ' ' LEU . 10.5 m-85 -104.49 135.3 46.17 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.59 1.556 . . . . 0.0 109.888 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -123.3 135.53 54.26 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 126.822 2.049 . . . . 0.0 109.793 179.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -104.72 130.42 52.79 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 122.754 1.264 . . . . 0.0 111.906 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.08 157.35 47.16 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 129.617 3.167 . . . . 0.0 108.386 -171.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.4 p -126.07 140.21 52.77 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 125.489 1.516 . . . . 0.0 111.656 172.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 85.54 78.04 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 127.738 2.415 . . . . 0.0 115.44 165.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.424 ' H ' ' HB3' ' A' ' 32' ' ' SER . 10.0 t -63.78 -28.28 69.76 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 117.218 2.303 . . . . 0.0 117.218 166.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.01 2.85 80.12 Favored Glycine 0 N--CA 1.472 1.059 1 C-N-CA 131.907 4.575 . . . . 0.0 115.501 -7.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 48.62 50.23 17.41 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 119.025 1.413 . . . . 0.0 110.296 -174.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.6 m -62.33 10.12 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 129.129 2.972 . . . . 0.0 117.671 -151.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -58.58 -32.28 68.81 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 121.314 -0.866 . . . . 0.0 111.175 157.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.5 -59.29 0.07 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 163.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? -165.8 145.25 6.31 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.203 1.001 . . . . 0.0 112.219 -166.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.424 ' HB3' ' H ' ' A' ' 25' ' ' SER . 0.4 OUTLIER -135.26 137.79 42.88 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 126.514 1.926 . . . . 0.0 110.766 174.777 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -104.35 135.45 45.77 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 104.038 -2.578 . . . . 0.0 104.038 166.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.6 t -115.17 130.32 69.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 122.153 0.978 . . . . 0.0 108.976 -168.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 52.7 mmm -117.03 119.45 35.32 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.513 0.725 . . . . 0.0 109.797 177.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.97 138.37 41.29 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.883 1.273 . . . . 0.0 110.207 177.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.466 HG13 ' CG ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -133.14 136.0 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.28 -0.887 . . . . 0.0 111.866 -177.881 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.35 127.07 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 161.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.3 141.93 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.897 1.679 . . . . 0.0 108.787 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.7 t70 56.65 -79.92 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 126.225 1.81 . . . . 0.0 113.698 -173.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -161.75 24.99 0.24 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 129.049 3.214 . . . . 0.0 110.418 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -124.35 156.68 36.62 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.182 2.593 . . . . 0.0 109.05 -169.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -134.61 136.93 43.27 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.952 0.901 . . . . 0.0 111.4 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -135.1 159.54 41.2 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.17 0.988 . . . . 0.0 111.736 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -131.12 129.21 41.55 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.727 2.011 . . . . 0.0 108.388 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.77 117.86 3.02 Favored Glycine 0 C--O 1.227 -0.301 0 C-N-CA 124.828 1.204 . . . . 0.0 110.293 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 p -104.72 116.32 31.83 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.475 1.11 . . . . 0.0 109.421 -173.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.404 ' HA3' ' N ' ' A' ' 54' ' ' ALA . . . -142.32 135.89 6.9 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 120.941 -1.1 . . . . 0.0 115.592 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.9 ttt85 -40.6 -22.9 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 170.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -153.53 -177.98 6.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.483 1.113 . . . . 0.0 111.16 147.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.439 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 35.4 mtmt -49.24 -37.5 23.54 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 126.644 1.978 . . . . 0.0 114.797 177.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -13.91 1.69 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 171.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.6 tp -121.58 -44.48 2.34 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.99 2.116 . . . . 0.0 110.26 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.66 -57.19 13.01 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 125.666 1.586 . . . . 0.0 112.4 175.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.501 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.5 ttmt -55.23 -44.28 75.32 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 116.507 -1.711 . . . . 0.0 110.936 168.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.57 -50.93 68.78 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 121.924 2.147 . . . . 0.0 112.741 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.6 mmm-85 -54.54 -58.6 6.86 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.146 2.178 . . . . 0.0 111.555 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.66 -54.16 47.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.941 0.897 . . . . 0.0 112.872 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.92 -55.85 15.19 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 126.88 2.072 . . . . 0.0 112.863 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -47.88 74.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 121.019 1.736 . . . . 0.0 111.406 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.0 m -55.05 -53.61 53.62 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.215 0.606 . . . . 0.0 112.049 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.06 -59.59 4.55 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.398 1.479 . . . . 0.0 111.734 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.43 -63.46 0.82 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 128.37 2.668 . . . . 0.0 110.627 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.95 -49.92 70.19 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.018 0.527 . . . . 0.0 111.082 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 46.4 m -55.24 -71.35 0.09 Allowed 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.276 11.4 m -55.59 -44.22 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.721 1.208 . . . . 0.0 114.062 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -55.97 -47.97 76.69 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 170.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -36.43 69.01 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.249 1.386 . . . . 0.0 113.903 168.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -38.1 89.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.405 1.082 . . . . 0.0 111.273 172.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.296 17.3 m-70 99.56 43.4 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 131.399 3.88 . . . . 0.0 112.276 175.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 43.6 tp . . . . . 0 C--O 1.252 1.216 0 C-N-CA 127.4 2.28 . . . . 0.0 110.258 171.594 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 CA--C 1.541 0.87 0 N-CA-C 113.812 0.658 . . . . 0.0 113.812 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.0 p -81.11 -8.09 59.69 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -152.85 -173.4 22.2 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.893 1.235 . . . . 0.0 114.263 175.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -141.89 28.84 1.72 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 -163.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -116.8 141.19 27.83 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 126.303 1.841 . . . . 0.0 108.287 171.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -70.06 -39.74 5.61 Favored 'Trans proline' 0 C--N 1.349 0.603 0 CA-C-N 120.915 1.363 . . . . 0.0 113.607 -169.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.446 HG22 ' HB3' ' A' ' 55' ' ' LYS . 59.9 t -54.46 -52.95 34.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -55.91 -53.02 61.93 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 116.051 1.871 . . . . 0.0 116.051 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.1 pt -57.66 -48.21 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.27 0.941 . . . . 0.0 113.507 171.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -55.71 -41.51 73.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 174.455 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.13 -56.67 17.28 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.527 1.931 . . . . 0.0 111.804 171.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.274 1.8 pt-20 -57.39 -59.78 4.63 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 175.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -55.8 -33.71 64.66 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 176.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.277 0.0 OUTLIER 15.04 67.87 0.16 Allowed Pre-proline 0 N--CA 1.487 1.415 0 C-N-CA 129.523 3.129 . . . . 0.0 118.092 -175.633 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.17 43.14 0.09 OUTLIER 'Trans proline' 0 CA--C 1.558 1.683 1 C-N-CA 125.921 4.414 . . . . 0.0 118.848 -175.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.45 32.85 24.05 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 120.065 -1.647 . . . . 0.0 113.771 177.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -103.8 166.63 10.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -166.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -134.79 138.77 44.57 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.922 2.089 . . . . 0.0 111.692 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -104.54 135.26 46.29 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.715 1.206 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -118.51 135.27 54.49 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 127.619 2.368 . . . . 0.0 109.261 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -108.66 124.78 51.05 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 122.331 1.062 . . . . 0.0 111.874 -174.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.417 ' HB2' HG13 ' A' ' 34' ' ' VAL . 3.8 mp -131.9 167.51 19.49 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 129.895 3.278 . . . . 0.0 106.309 -173.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.9 p -141.51 168.82 18.85 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 119.937 -1.727 . . . . 0.0 113.168 159.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.278 3.4 tp10 122.92 7.34 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 128.223 2.609 . . . . 0.0 113.65 142.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -62.44 32.93 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 130.205 3.402 . . . . 0.0 115.989 175.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.4 169.66 16.46 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 126.277 1.894 . . . . 0.0 113.597 -170.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -69.22 170.25 10.54 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.684 1.194 . . . . 0.0 113.193 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 72.8 p -70.36 40.26 0.05 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 125.727 1.611 . . . . 0.0 113.102 162.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -153.5 -40.11 0.1 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.558 1.943 . . . . 0.0 112.63 -171.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -154.55 154.43 33.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.918 0.887 . . . . 0.0 112.9 -176.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -64.62 158.12 25.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.322 1.449 . . . . 0.0 114.347 -178.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.3 m -135.22 135.6 41.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.57 152.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -96.74 135.52 38.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 170.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.417 HG13 ' HB2' ' A' ' 22' ' ' LEU 0.327 0.1 OUTLIER -107.53 135.02 47.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 122.745 1.26 . . . . 0.0 112.561 175.759 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 76.1 mmm -125.16 117.33 23.64 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.406 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.3 m -115.83 135.19 54.24 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.386 0.674 . . . . 0.0 109.709 -172.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -121.33 135.81 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.446 1.098 . . . . 0.0 112.067 -174.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.3 t -104.41 125.98 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 165.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.3 p -146.71 145.37 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 126.878 2.071 . . . . 0.0 109.095 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.5 t70 62.16 -23.66 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 130.62 3.78 4.52 Favored Glycine 0 CA--C 1.544 1.87 0 C-N-CA 126.569 2.033 . . . . 0.0 113.585 -167.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -135.02 165.7 24.74 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.192 2.197 . . . . 0.0 111.832 -173.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.23 137.22 44.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.365 1.066 . . . . 0.0 112.689 -163.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -135.03 150.72 50.35 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.131 1.773 . . . . 0.0 110.809 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.53 110.55 10.56 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.288 1.035 . . . . 0.0 110.557 -174.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.97 109.1 3.21 Favored Glycine 0 CA--C 1.527 0.792 0 C-N-CA 126.018 1.771 . . . . 0.0 112.018 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.0 m -108.02 104.94 14.49 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.052 0.926 . . . . 0.0 112.601 -172.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.45 136.46 7.89 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.832 1.682 . . . . 0.0 114.791 -172.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -13.63 -59.1 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 127.057 2.143 . . . . 0.0 116.739 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -136.94 177.2 8.05 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.067 1.747 . . . . 0.0 109.908 169.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -46.88 -46.01 20.82 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 120.015 1.28 . . . . 0.0 114.093 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.63 -23.43 1.7 Allowed 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 174.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -108.39 -40.19 5.21 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.235 1.414 . . . . 0.0 111.31 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.39 -56.83 15.63 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.694 1.197 . . . . 0.0 112.575 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.446 ' HB3' HG22 ' A' ' 7' ' ' VAL . 11.0 mmtt -55.41 -35.63 65.56 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 115.698 -2.096 . . . . 0.0 113.249 165.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.55 -54.81 39.36 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 122.501 2.41 . . . . 0.0 110.94 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -55.0 -53.26 58.04 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.305 2.242 . . . . 0.0 114.05 169.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.51 -56.67 17.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.225 1.01 . . . . 0.0 111.952 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.33 -60.07 2.55 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.291 1.036 . . . . 0.0 113.207 166.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -50.51 -48.43 57.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.336 1.454 . . . . 0.0 112.92 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.12 -59.16 5.15 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 112.486 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.17 -57.1 13.13 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.869 -1.062 . . . . 0.0 111.998 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -42.15 -64.32 0.61 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.288 2.635 . . . . 0.0 111.121 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.82 66.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.129 0.422 . . . . 0.0 111.092 -178.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 41.0 m -55.44 -73.17 0.06 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 175.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.253 11.6 m -55.52 -42.02 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.73 1.212 . . . . 0.0 113.845 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -56.63 -47.02 80.59 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.638 1.108 . . . . 0.0 113.4 169.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -55.3 -33.8 63.58 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 169.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt -63.4 -59.11 5.12 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.242 0.928 . . . . 0.0 110.746 167.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -169.3 -42.18 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.652 1.581 . . . . 0.0 113.896 164.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.247 0.955 0 C-N-CA 127.54 2.336 . . . . 0.0 111.152 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo . . . . . 0 CA--C 1.54 0.824 0 CA-C-O 119.565 -0.265 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.7 m 50.38 29.38 3.83 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 124.654 1.182 . . . . 0.0 113.016 -161.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 161.07 170.35 25.57 Favored Glycine 0 CA--C 1.537 1.425 0 C-N-CA 127.637 2.542 . . . . 0.0 110.824 -166.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -148.31 165.47 30.93 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.614 1.166 . . . . 0.0 113.821 -171.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -58.53 142.56 82.49 Favored Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 126.473 1.909 . . . . 0.0 113.607 -172.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.28 -37.78 5.47 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.72 2.28 . . . . 0.0 114.58 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.426 HG22 ' HB3' ' A' ' 55' ' ' LYS . 42.3 t -54.99 -50.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 122.152 0.977 . . . . 0.0 109.067 172.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.54 -49.99 71.19 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.258 10.7 pt -58.8 -48.89 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-N 120.653 1.569 . . . . 0.0 114.563 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.283 0.0 OUTLIER -55.53 -39.95 71.21 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.022 -1.049 . . . . 0.0 113.434 176.045 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -58.57 7.12 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.614 1.966 . . . . 0.0 112.117 167.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.8 -54.93 38.46 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.408 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 11.5 mt -55.9 -42.19 75.64 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.139 1.375 . . . . 0.0 114.584 172.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 27.38 65.17 0.59 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 128.369 2.668 . . . . 0.0 116.202 -171.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.97 74.74 0.05 OUTLIER 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 124.953 3.769 . . . . 0.0 117.117 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.86 35.15 89.73 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.691 1.615 . . . . 0.0 114.936 173.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 pp -111.81 157.46 20.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -154.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.78 141.09 44.74 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 127.419 2.288 . . . . 0.0 114.175 167.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -104.48 135.36 46.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.451 1.101 . . . . 0.0 111.44 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.58 135.43 48.12 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.909 2.083 . . . . 0.0 110.064 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -104.58 129.69 52.65 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 123.312 1.53 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -134.76 145.33 48.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 130.369 3.468 . . . . 0.0 105.944 -168.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.6 t -144.74 74.15 1.4 Allowed 'General case' 0 C--N 1.317 -0.845 0 O-C-N 118.921 -2.362 . . . . 0.0 108.264 -171.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -166.19 -12.77 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 1 N-CA-C 123.286 4.55 . . . . 0.0 123.286 -152.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -78.04 39.25 0.3 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 122.114 2.233 . . . . 0.0 113.103 -179.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.34 -146.26 5.07 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.932 1.253 . . . . 0.0 113.452 -162.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 67.77 -27.68 0.14 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 129.099 2.96 . . . . 0.0 116.195 174.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.8 t -73.81 0.36 13.42 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.221 1.408 . . . . 0.0 112.666 159.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -148.89 -59.24 0.22 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.548 1.539 . . . . 0.0 112.454 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -158.75 159.29 35.04 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.96 2.104 . . . . 0.0 109.708 176.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 tptp -62.1 133.77 55.71 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.265 0.939 . . . . 0.0 112.39 -176.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.6 m -132.26 133.51 44.19 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.615 1.166 . . . . 0.0 111.453 173.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -104.98 135.05 47.04 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 174.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 98.0 t -118.07 134.88 60.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 123.3 1.524 . . . . 0.0 109.45 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.06 124.29 46.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 171.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.3 t -120.22 134.35 55.28 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.676 0.671 . . . . 0.0 111.139 169.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -121.51 135.63 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.548 0.739 . . . . 0.0 110.322 -169.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -94.85 114.27 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.2 t -138.52 137.0 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.596 1.958 . . . . 0.0 108.337 -168.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 t70 59.02 -66.34 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.75 2.02 . . . . 0.0 114.044 -170.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 18.97 0.06 OUTLIER Glycine 0 CA--C 1.542 1.737 0 C-N-CA 128.031 2.729 . . . . 0.0 112.692 170.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -135.21 165.11 26.17 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.931 2.492 . . . . 0.0 110.944 -168.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -127.01 128.68 46.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.756 0.822 . . . . 0.0 112.508 -162.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -135.11 103.3 5.5 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.445 1.098 . . . . 0.0 113.533 -164.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -77.84 135.26 37.9 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 127.605 2.362 . . . . 0.0 110.432 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.98 123.67 3.19 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 125.948 1.737 . . . . 0.0 110.34 174.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.2 t -113.63 113.01 24.45 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.817 0.847 . . . . 0.0 111.175 -173.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.74 149.91 20.17 Favored Glycine 0 CA--C 1.529 0.939 0 C-N-CA 125.387 1.47 . . . . 0.0 115.767 -174.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -53.32 -23.01 8.17 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 175.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -157.7 -174.82 5.05 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.94 1.696 . . . . 0.0 110.288 152.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -45.19 -49.24 12.31 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.993 1.717 . . . . 0.0 114.27 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -14.15 1.13 Allowed 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.5 tp -114.66 -41.31 3.43 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.334 1.854 . . . . 0.0 111.294 172.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -55.29 33.47 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.371 174.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.426 ' HB3' HG22 ' A' ' 7' ' ' VAL . 13.5 mmtt -55.35 -41.93 73.2 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-O 115.413 -2.232 . . . . 0.0 113.593 162.04 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -50.19 70.59 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 123.444 2.838 . . . . 0.0 111.17 -178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -54.99 -58.16 8.77 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 129.222 3.009 . . . . 0.0 113.259 168.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -56.38 20.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.673 1.189 . . . . 0.0 112.168 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -44.86 -60.33 2.1 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.271 1.428 . . . . 0.0 114.454 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -55.01 -45.45 75.1 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.794 1.179 . . . . 0.0 112.716 -177.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.48 -56.84 15.56 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.32 1.048 . . . . 0.0 112.507 171.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -59.35 4.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.62 1.168 . . . . 0.0 112.24 177.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -57.62 5.82 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.871 2.068 . . . . 0.0 111.884 178.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.97 -49.07 72.33 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.133 0.424 . . . . 0.0 111.331 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -55.28 -68.06 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.3 m -55.47 -46.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -177.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.408 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 8.8 m-30 -55.94 -48.34 75.92 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -38.07 69.08 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.054 0.843 . . . . 0.0 112.556 170.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.5 -60.18 3.9 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.504 1.122 . . . . 0.0 110.181 168.246 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -173.89 169.98 3.99 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.158 1.783 . . . . 0.0 114.32 158.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 44.8 tp . . . . . 0 C--O 1.251 1.184 0 C-N-CA 127.254 2.221 . . . . 0.0 111.198 167.819 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_exo . . . . . 0 N--CA 1.483 0.887 0 N-CA-C 110.528 -0.605 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 p 55.03 176.33 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.796 1.239 . . . . 0.0 113.124 -135.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.94 177.93 41.42 Favored Glycine 0 CA--C 1.53 1.022 0 O-C-N 121.018 -1.051 . . . . 0.0 114.037 -175.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -68.59 -8.36 41.09 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -167.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -148.13 157.2 43.2 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 125.5 1.52 . . . . 0.0 110.562 171.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -66.53 -31.83 40.73 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.41 2.073 . . . . 0.0 114.659 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.531 HG13 ' HG2' ' A' ' 55' ' ' LYS . 95.5 t -54.78 -50.83 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -55.29 -44.45 75.74 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.993 1.317 . . . . 0.0 114.401 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.438 ' H ' HG13 ' A' ' 9' ' ' ILE . 8.5 mt -55.92 -59.51 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 125.254 1.422 . . . . 0.0 112.316 168.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.264 0.0 OUTLIER -55.54 -39.31 70.4 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.696 0.798 . . . . 0.0 112.447 -179.556 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.58 -57.71 10.8 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 127.538 2.335 . . . . 0.0 112.163 168.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -55.37 -58.05 9.34 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.601 1.56 . . . . 0.0 112.001 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 13.3 mt -55.82 -35.76 66.73 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.423 ' HA ' ' HD2' ' A' ' 15' ' ' PRO 0.366 0.0 OUTLIER -10.11 90.71 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.238 0 C-N-CA 127.835 2.454 . . . . 0.0 117.387 -161.883 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 14' ' ' ARG . 74.0 Cg_endo -66.98 -166.1 0.11 Allowed 'Trans proline' 0 CA--C 1.549 1.234 0 C-N-CA 122.457 2.105 . . . . 0.0 111.544 169.251 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.43 66.04 0.4 Allowed Glycine 0 CA--C 1.539 1.547 0 O-C-N 120.631 -1.293 . . . . 0.0 114.117 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 pp -112.0 167.14 10.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.848 1.659 . . . . 0.0 113.343 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -135.23 138.87 43.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.54 1.536 . . . . 0.0 112.443 167.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -104.25 135.24 46.09 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.353 1.073 . . . . 0.0 109.62 172.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -114.08 135.33 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 127.83 2.452 . . . . 0.0 108.568 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -107.04 119.65 39.96 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.351 1.072 . . . . 0.0 111.147 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.38 150.48 45.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 129.827 3.251 . . . . 0.0 106.808 -177.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.2 p -123.93 134.19 53.57 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 120.343 -1.473 . . . . 0.0 112.068 174.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.341 6.0 mm-40 97.9 60.4 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 127.73 2.412 . . . . 0.0 115.339 162.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.0 t -64.41 114.04 4.04 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 138.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -147.03 -173.44 18.25 Favored Glycine 0 CA--C 1.539 1.537 0 O-C-N 121.386 -0.821 . . . . 0.0 114.453 -163.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.28 -146.74 0.07 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 129.101 2.96 . . . . 0.0 112.153 1.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.1 m -54.96 -15.79 2.26 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 -170.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -69.26 -36.82 77.52 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.618 1.099 . . . . 0.0 112.632 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -97.2 -43.96 7.14 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.443 1.097 . . . . 0.0 112.214 176.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 tptt 29.23 53.65 0.1 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 129.09 2.956 . . . . 0.0 114.577 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.3 m -112.88 137.19 51.61 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 126.53 1.932 . . . . 0.0 112.51 -159.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -93.86 135.74 34.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 103.994 -2.595 . . . . 0.0 103.994 177.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -116.49 114.16 45.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -158.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 72.9 mmm -104.72 118.49 36.7 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.2 m -123.72 135.29 53.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.819 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.27 135.88 53.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 123.714 0.806 . . . . 0.0 109.671 -158.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.0 t -104.13 112.85 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.0 t -137.96 136.35 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.893 2.077 . . . . 0.0 107.963 -164.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.1 t70 59.83 -65.62 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 127.213 2.205 . . . . 0.0 114.167 -171.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -174.92 20.66 0.05 OUTLIER Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.117 2.77 . . . . 0.0 112.033 174.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.09 166.84 22.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 127.248 2.219 . . . . 0.0 109.613 -167.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -121.87 138.53 54.36 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.995 0.918 . . . . 0.0 111.779 -175.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -134.77 148.3 50.2 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.083 1.753 . . . . 0.0 109.519 -173.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -133.94 131.49 39.09 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.618 1.167 . . . . 0.0 109.985 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -129.37 113.45 1.52 Allowed Glycine 0 CA--C 1.522 0.474 0 C-N-CA 125.077 1.322 . . . . 0.0 111.381 -173.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -104.81 104.69 14.51 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.115 0.966 . . . . 0.0 111.171 -172.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.01 137.97 9.54 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 124.496 1.046 . . . . 0.0 115.42 -176.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -35.76 -44.41 0.34 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 115.383 1.623 . . . . 0.0 115.383 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -139.97 179.19 6.75 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.292 1.037 . . . . 0.0 111.171 158.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 54.2 mttp -47.25 -35.1 7.25 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 126.589 1.955 . . . . 0.0 115.838 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.07 -15.4 5.21 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.5 tp -124.04 -41.74 2.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.267 2.227 . . . . 0.0 110.728 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.432 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.7 -58.27 8.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.967 1.307 . . . . 0.0 112.912 172.519 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.531 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.0 ttmt -55.25 -46.34 76.08 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-O 116.886 -1.531 . . . . 0.0 110.127 169.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.59 75.0 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 121.594 1.997 . . . . 0.0 113.174 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -55.39 -57.5 11.61 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 170.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.93 49.92 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.489 0.716 . . . . 0.0 112.574 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.19 -59.11 4.25 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.635 2.374 . . . . 0.0 112.455 172.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.12 -49.42 71.82 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.998 1.272 . . . . 0.0 111.687 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.7 m -55.42 -55.07 35.87 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.029 0.932 . . . . 0.0 112.542 175.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -55.74 27.8 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.769 1.228 . . . . 0.0 111.841 175.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.42 -57.82 2.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.481 2.312 . . . . 0.0 110.68 175.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.87 -54.17 45.98 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 122.834 0.454 . . . . 0.0 111.638 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.3 m -55.15 -68.69 0.17 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.278 21.1 m -55.51 -46.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -57.74 -46.66 84.17 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.72 -36.79 67.62 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.391 1.45 . . . . 0.0 113.635 169.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.13 -42.92 99.59 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.864 1.265 . . . . 0.0 111.466 169.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.286 25.4 m-70 103.9 39.68 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 131.393 3.877 . . . . 0.0 112.825 174.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 61.5 mt . . . . . 0 C--O 1.253 1.27 0 C-N-CA 126.598 1.959 . . . . 0.0 112.906 174.879 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo . . . . . 0 N--CA 1.489 1.255 0 N-CA-C 110.805 -0.498 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 p -59.3 160.88 6.06 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 122.079 -0.388 . . . . 0.0 111.44 139.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.5 -31.29 0.08 OUTLIER Glycine 0 CA--C 1.536 1.376 0 N-CA-C 116.376 1.31 . . . . 0.0 116.376 175.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -151.3 25.27 0.71 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.007 1.323 . . . . 0.0 112.855 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -149.07 92.33 4.36 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 126.429 1.892 . . . . 0.0 109.298 -158.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.25 -35.12 53.44 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.328 2.019 . . . . 0.0 115.275 -159.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.449 HG22 ' HB3' ' A' ' 55' ' ' LYS . 59.5 t -46.87 -58.59 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.117 0.967 . . . . 0.0 109.264 169.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.0 tpp -55.69 -43.91 76.85 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.7 1.6 . . . . 0.0 114.412 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.1 mt -55.59 -59.67 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.389 0.995 . . . . 0.0 110.928 173.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.419 ' HB2' HD13 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -50.28 -48.41 54.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.489 1.516 . . . . 0.0 111.236 176.278 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -57.89 -55.38 35.59 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 124.72 1.208 . . . . 0.0 113.881 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -56.45 -45.3 80.89 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.274 1.83 . . . . 0.0 113.765 174.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.58 -37.68 68.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.201 1.8 . . . . 0.0 112.951 169.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.8 ptt-85 34.8 66.4 1.49 Allowed Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 127.63 2.372 . . . . 0.0 114.412 -178.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.71 60.64 1.19 Allowed 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 124.922 3.748 . . . . 0.0 113.06 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.92 25.99 64.81 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.019 1.771 . . . . 0.0 115.064 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.413 ' HB3' HG12 ' A' ' 39' ' ' VAL . 1.1 pp -79.06 162.05 26.15 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 116.432 2.012 . . . . 0.0 116.432 -159.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -135.21 137.18 42.39 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.303 2.241 . . . . 0.0 110.713 164.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -104.39 135.32 46.05 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 124.587 1.18 . . . . 0.0 111.465 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -121.28 135.57 55.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 127.614 2.366 . . . . 0.0 109.68 -177.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -104.49 124.16 48.78 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 122.772 1.272 . . . . 0.0 109.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.429 ' CB ' HG13 ' A' ' 34' ' ' VAL . 1.3 mm? -123.84 159.46 29.53 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 130.239 3.416 . . . . 0.0 103.645 178.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.6 p -149.87 115.36 5.52 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 118.753 -2.467 . . . . 0.0 112.847 167.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -162.27 0.01 0.05 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.266 1.426 . . . . 0.0 113.392 -165.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.3 t -83.95 11.86 7.12 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.22 1.408 . . . . 0.0 113.552 -169.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 158.06 117.46 0.51 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.296 1.427 . . . . 0.0 110.766 -170.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -112.84 -4.04 14.05 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.29 1.036 . . . . 0.0 113.254 -172.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.6 m -75.06 48.87 0.41 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 127.544 2.338 . . . . 0.0 113.662 -174.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 26.4 t60 64.25 -32.12 0.13 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 129.426 3.091 . . . . 0.0 115.774 -172.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.96 58.9 0.16 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.614 1.966 . . . . 0.0 111.462 164.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -55.24 133.09 49.1 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.083 1.753 . . . . 0.0 112.27 -171.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.7 m -135.13 135.82 41.43 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 123.184 1.469 . . . . 0.0 113.807 -158.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -104.6 135.24 46.38 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.607 -152.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.429 HG13 ' CB ' ' A' ' 22' ' ' LEU 0.258 0.1 OUTLIER -104.96 134.5 46.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 122.843 1.306 . . . . 0.0 111.768 167.38 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 67.1 mmm -117.76 127.13 53.61 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -122.96 135.24 54.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -119.58 135.71 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 111.076 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.8 t -102.25 124.67 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 104.87 -2.27 . . . . 0.0 104.87 161.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.413 HG12 ' HB3' ' A' ' 17' ' ' LEU . 4.8 m -138.29 150.28 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.936 2.094 . . . . 0.0 108.159 -173.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.2 t70 54.97 -79.28 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 125.204 1.401 . . . . 0.0 113.552 -175.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -159.67 20.9 0.27 Allowed Glycine 0 CA--C 1.544 1.844 0 C-N-CA 127.988 2.709 . . . . 0.0 112.5 167.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -135.13 170.29 16.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.834 2.453 . . . . 0.0 112.583 -172.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -134.5 136.44 43.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.92 0.888 . . . . 0.0 112.991 -162.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.421 ' HZ ' HG21 ' A' ' 65' ' ' THR . 44.1 m-85 -134.98 149.6 50.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.049 1.74 . . . . 0.0 111.102 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -132.27 125.95 32.24 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.897 1.279 . . . . 0.0 109.846 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.05 112.91 2.12 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 126.019 1.771 . . . . 0.0 111.569 -169.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -104.9 112.84 26.12 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.432 1.116 . . . . 0.0 111.059 -170.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.69 136.42 8.46 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 125.694 1.616 . . . . 0.0 116.702 -165.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.1 mmm-85 -55.51 -13.81 1.72 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 170.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -152.88 165.59 34.96 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 128.186 2.594 . . . . 0.0 109.139 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -51.37 -42.83 61.63 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 121.158 1.799 . . . . 0.0 113.376 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -5.7 3.44 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 174.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.58 -50.93 3.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.214 1.406 . . . . 0.0 109.067 170.2 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.36 -59.4 4.85 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.594 1.958 . . . . 0.0 113.459 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HB3' HG22 ' A' ' 7' ' ' VAL . 6.7 mmtt -55.53 -38.34 69.11 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 115.479 -2.2 . . . . 0.0 113.081 163.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 -50.77 68.89 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 123.462 2.847 . . . . 0.0 111.944 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -55.34 -58.25 8.49 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.269 3.428 . . . . 0.0 113.347 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.4 -56.31 21.6 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.066 1.347 . . . . 0.0 111.593 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.68 -55.28 11.77 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 168.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -55.1 -47.75 74.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 120.822 1.646 . . . . 0.0 112.911 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -55.12 -56.69 16.98 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.54 1.136 . . . . 0.0 112.298 172.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -55.04 35.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.638 1.175 . . . . 0.0 112.279 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.419 HD13 ' HB2' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -48.37 -60.83 2.36 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.762 2.425 . . . . 0.0 109.8 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.09 -48.45 73.55 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.774 0.43 . . . . 0.0 111.31 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.421 HG21 ' HZ ' ' A' ' 44' ' ' PHE . 49.2 m -55.37 -69.3 0.14 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.772 1.026 . . . . 0.0 113.772 173.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.4 m -55.27 -41.33 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.287 0.948 . . . . 0.0 112.957 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.23 -45.24 80.05 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.82 -1.175 . . . . 0.0 113.724 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -36.53 67.2 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 164.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.4 mt -67.89 -23.25 65.09 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 119.518 1.054 . . . . 0.0 112.598 169.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.27 12.6 m-70 77.25 45.47 0.08 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 128.772 2.829 . . . . 0.0 112.169 -175.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 tp . . . . . 0 C--O 1.25 1.093 0 C-N-CA 127.963 2.505 . . . . 0.0 111.703 -179.729 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo . . . . . 0 N--CA 1.483 0.906 0 N-CA-C 112.851 0.289 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 p -114.31 -6.16 12.95 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.085 1.354 . . . . 0.0 114.386 -173.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 179.56 169.25 39.66 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.445 1.497 . . . . 0.0 112.877 174.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -73.17 -23.77 60.48 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.977 0.911 . . . . 0.0 112.781 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -162.25 166.05 14.7 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 128.79 2.836 . . . . 0.0 108.293 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -64.53 -31.65 60.26 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 121.999 1.8 . . . . 0.0 114.77 -176.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.712 HG13 ' HG2' ' A' ' 55' ' ' LYS . 57.3 t -55.06 -50.28 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 173.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.08 -45.06 75.37 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.682 1.193 . . . . 0.0 113.208 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 12.2 mt -55.65 -63.6 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.342 1.057 . . . . 0.0 110.874 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -41.69 72.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.964 0.906 . . . . 0.0 112.842 -176.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.36 -63.64 1.1 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.093 1.757 . . . . 0.0 111.442 174.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -56.01 -48.9 75.05 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.403 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 1.7 mt -55.66 -35.0 65.48 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 172.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 ptt-85 33.94 59.16 1.95 Allowed Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 127.259 2.224 . . . . 0.0 115.2 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -68.01 70.78 0.84 Allowed 'Trans proline' 0 CA--C 1.548 1.203 0 C-N-CA 124.665 3.577 . . . . 0.0 114.241 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.16 30.02 74.58 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.966 1.746 . . . . 0.0 114.911 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -99.6 163.88 12.31 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 117.115 2.265 . . . . 0.0 117.115 -156.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.37 141.95 45.64 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 127.127 2.171 . . . . 0.0 112.065 161.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.428 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 29.7 m-85 -104.57 135.24 46.35 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.413 1.102 . . . . 0.0 110.874 176.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -107.46 135.73 48.44 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 128.478 2.711 . . . . 0.0 109.9 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -104.61 127.98 52.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 122.751 1.262 . . . . 0.0 110.352 174.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.9 135.83 41.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 130.014 3.326 . . . . 0.0 106.11 -171.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 t -71.83 -28.08 63.34 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 118.476 2.769 . . . . 0.0 118.476 -166.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -143.65 -36.7 0.35 Allowed 'General case' 0 N--CA 1.482 1.15 0 O-C-N 116.582 -3.824 . . . . 0.0 110.053 -45.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.9 t -75.71 77.77 2.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.311 2.245 . . . . 0.0 111.602 -171.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.77 -60.31 0.08 OUTLIER Glycine 0 CA--C 1.54 1.637 0 C-N-CA 125.108 1.337 . . . . 0.0 113.051 166.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -58.62 -49.32 77.94 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 121.106 2.453 . . . . 0.0 111.119 -10.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.4 p -92.06 -35.97 13.62 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.508 1.923 . . . . 0.0 113.444 173.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -54.91 -27.98 47.21 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.924 1.69 . . . . 0.0 114.848 -172.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -135.4 23.46 3.45 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.637 1.575 . . . . 0.0 112.335 175.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -16.74 89.73 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 129.236 3.015 . . . . 0.0 115.867 -166.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.7 m -133.37 135.75 44.91 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 126.784 2.034 . . . . 0.0 109.287 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -96.59 135.88 37.88 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.9 t -115.31 125.64 72.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 123.382 1.563 . . . . 0.0 108.696 -161.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.6 mmt -112.34 122.58 48.13 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.019 -1.446 . . . . 0.0 107.731 173.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -122.82 135.52 54.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.428 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -128.62 135.68 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.14 0.976 . . . . 0.0 111.365 -168.113 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.5 t -104.23 122.96 57.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 105.619 -1.993 . . . . 0.0 105.619 166.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -142.33 151.08 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.325 1.85 . . . . 0.0 108.37 -175.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.5 t70 58.01 -70.5 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.328 1.851 . . . . 0.0 114.13 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.22 18.45 0.09 OUTLIER Glycine 0 CA--C 1.543 1.817 0 C-N-CA 128.037 2.732 . . . . 0.0 112.946 167.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -135.33 169.45 17.46 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.756 2.422 . . . . 0.0 112.382 -168.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -134.21 138.83 45.38 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.466 1.106 . . . . 0.0 113.524 -166.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -135.12 158.75 43.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.874 1.67 . . . . 0.0 112.318 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -128.75 135.05 48.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.892 2.077 . . . . 0.0 109.449 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.86 122.21 3.13 Favored Glycine 0 CA--C 1.524 0.646 0 C-N-CA 125.494 1.521 . . . . 0.0 111.304 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 m -118.07 104.74 11.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 117.896 0.848 . . . . 0.0 110.903 -168.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 146.2 18.19 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.43 1.967 . . . . 0.0 114.347 -170.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -44.71 -33.06 1.71 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -155.51 179.31 9.3 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.881 1.672 . . . . 0.0 109.684 162.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.5 mtmt -43.39 -41.87 4.39 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 127.636 2.374 . . . . 0.0 115.709 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.99 -15.92 4.16 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 174.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -122.92 -42.48 2.29 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.931 2.092 . . . . 0.0 111.297 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.42 -57.89 10.02 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.227 1.411 . . . . 0.0 112.295 172.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.712 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.7 ttmt -55.37 -44.46 76.05 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-O 117.586 -1.197 . . . . 0.0 110.863 170.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 -51.9 65.0 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 120.341 1.428 . . . . 0.0 113.463 178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.6 mmm-85 -55.36 -53.39 56.8 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.164 1.785 . . . . 0.0 113.24 170.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.79 65.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.97 0.908 . . . . 0.0 112.319 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.71 67.63 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 127.298 2.239 . . . . 0.0 112.403 171.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -55.01 -51.01 67.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.234 1.414 . . . . 0.0 111.822 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -55.26 -54.0 48.97 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.868 0.867 . . . . 0.0 112.812 171.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.23 -55.95 25.48 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.611 1.165 . . . . 0.0 113.19 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -59.8 3.5 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 127.826 2.45 . . . . 0.0 110.545 177.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.23 -49.6 69.07 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.177 0.298 . . . . 0.0 111.078 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 44.8 m -55.28 -72.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.541 1.136 . . . . 0.0 113.98 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.251 24.4 m -55.54 -46.17 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.403 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 5.8 m-30 -59.64 -44.69 93.41 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 174.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -55.58 -39.36 70.6 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.916 1.235 . . . . 0.0 113.887 168.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.61 -30.03 71.04 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.579 1.552 . . . . 0.0 112.215 167.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.303 94.2 m-70 76.46 47.31 0.08 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 128.766 2.827 . . . . 0.0 113.166 -173.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.25 1.106 0 C-N-CA 127.531 2.333 . . . . 0.0 110.078 170.531 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.541 0.826 0 N-CA-C 112.342 0.093 . . . . 0.0 112.342 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.7 p -71.56 39.74 0.07 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.656 1.982 . . . . 0.0 114.951 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -176.18 -176.86 44.73 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.966 1.269 . . . . 0.0 113.47 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.0 ttpp -66.7 -9.94 41.48 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -169.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -45.54 -57.65 7.31 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 125.657 1.583 . . . . 0.0 114.917 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.72 -31.23 26.21 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.482 2.121 . . . . 0.0 113.627 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.711 HG13 ' HG2' ' A' ' 55' ' ' LYS . 60.4 t -55.07 -50.3 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.165 0.893 . . . . 0.0 109.214 173.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.28 -53.6 54.07 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.944 1.298 . . . . 0.0 114.271 -177.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 15.0 pt -58.71 -49.88 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 172.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.4 ' HB2' ' CD1' ' A' ' 63' ' ' LEU 0.252 0.0 OUTLIER -55.59 -45.33 77.42 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.663 1.12 . . . . 0.0 113.838 176.981 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.13 -56.46 19.67 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 127.106 2.163 . . . . 0.0 111.432 174.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.61 -63.82 1.05 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.111 1.364 . . . . 0.0 114.042 173.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.7 mt -55.54 -23.73 28.2 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 35.92 51.21 1.5 Allowed Pre-proline 0 N--CA 1.48 1.07 0 C-N-CA 127.557 2.343 . . . . 0.0 114.778 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.73 46.85 1.99 Allowed 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 124.657 3.571 . . . . 0.0 116.012 -156.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.04 20.16 Favored Glycine 0 CA--C 1.534 1.251 0 O-C-N 120.521 -1.362 . . . . 0.0 113.538 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -97.58 166.27 11.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.774 1.63 . . . . 0.0 114.933 -173.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.63 150.77 49.74 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.299 1.44 . . . . 0.0 112.654 145.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.55 135.83 45.25 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.842 1.257 . . . . 0.0 112.145 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -124.66 135.72 53.31 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.695 1.598 . . . . 0.0 110.266 166.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -104.42 135.14 46.42 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 123.381 1.562 . . . . 0.0 110.678 -175.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -134.5 161.74 34.21 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 131.691 3.996 . . . . 0.0 106.1 -164.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.7 m -140.81 159.82 41.39 Favored 'General case' 0 C--N 1.319 -0.759 0 O-C-N 119.64 -1.913 . . . . 0.0 112.488 158.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.313 59.3 mm-40 94.26 22.31 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 128.971 2.908 . . . . 0.0 117.283 162.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.4 m -68.2 49.16 0.06 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.561 1.544 . . . . 0.0 112.804 161.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -49.89 141.02 15.46 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.997 1.284 . . . . 0.0 112.571 -173.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -129.75 158.89 38.16 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.024 1.33 . . . . 0.0 109.779 -176.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.1 m -57.08 -10.5 1.19 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 118.483 2.772 . . . . 0.0 118.483 -148.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -132.23 1.33 3.83 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 126.155 1.782 . . . . 0.0 114.113 176.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -153.88 151.24 29.25 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 -170.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -57.24 153.56 11.82 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.779 2.032 . . . . 0.0 111.497 164.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 72.0 m -130.22 121.85 26.97 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.097 1.359 . . . . 0.0 110.854 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -104.52 135.57 45.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 104.488 -2.412 . . . . 0.0 104.488 155.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 69.2 t -120.76 130.07 74.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.29 1.043 . . . . 0.0 110.841 -159.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 13.5 mmm -109.22 123.23 48.91 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 171.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.6 p -104.88 135.62 45.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.227 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -125.25 135.47 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.788 -0.57 . . . . 0.0 111.264 172.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.3 t -104.54 124.16 58.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 165.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.4 p -152.28 140.96 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.305 1.042 . . . . 0.0 110.174 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.5 t70 62.3 -25.16 0.05 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.937 2.095 . . . . 0.0 116.327 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 133.17 -4.76 4.95 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 126.939 2.209 . . . . 0.0 112.886 -165.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -105.02 168.02 9.33 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.223 2.209 . . . . 0.0 110.808 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -135.09 139.89 45.08 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.076 1.35 . . . . 0.0 110.643 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -135.06 150.84 50.34 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.529 1.132 . . . . 0.0 111.041 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -115.29 135.09 54.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.025 1.73 . . . . 0.0 109.351 166.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.62 114.22 2.79 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 125.11 1.338 . . . . 0.0 110.373 168.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.8 p -104.83 108.86 20.57 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 122.577 1.18 . . . . 0.0 109.601 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.44 140.8 11.97 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 126.192 1.853 . . . . 0.0 113.283 -165.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -17.07 6.16 Favored 'General case' 0 CA--C 1.557 1.237 0 O-C-N 121.291 -1.123 . . . . 0.0 113.947 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -160.42 162.24 33.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 129.429 3.092 . . . . 0.0 109.584 170.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.46 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 50.2 mttp -43.93 -37.73 3.04 Favored 'General case' 0 N--CA 1.5 2.063 0 CA-C-N 121.707 2.048 . . . . 0.0 115.455 172.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -14.43 7.4 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 120.159 1.345 . . . . 0.0 114.218 174.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.0 tp -122.24 -40.0 2.53 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.294 2.238 . . . . 0.0 111.897 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.67 -55.25 34.33 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.405 -1.434 . . . . 0.0 111.737 173.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.711 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.5 ttmt -55.32 -41.84 72.96 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-O 117.785 -1.102 . . . . 0.0 111.768 168.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.58 -50.78 69.17 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 120.429 1.468 . . . . 0.0 113.677 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -55.5 -54.06 48.66 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 128.563 2.745 . . . . 0.0 112.661 169.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -53.82 51.39 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.869 1.268 . . . . 0.0 111.672 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.43 -56.82 8.39 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 126.794 2.038 . . . . 0.0 112.269 169.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -52.64 -49.41 65.24 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.112 1.365 . . . . 0.0 112.525 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.22 -57.94 9.72 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.105 1.362 . . . . 0.0 112.165 173.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.464 ' O ' HG22 ' A' ' 66' ' ' VAL . . . -55.18 -56.73 16.62 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.651 1.18 . . . . 0.0 112.354 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.4 ' CD1' ' HB2' ' A' ' 10' ' ' LEU . 0.4 OUTLIER -44.5 -63.82 0.82 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 128.208 2.603 . . . . 0.0 110.82 176.728 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.48 -51.65 62.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 117.82 0.282 . . . . 0.0 110.94 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.0 m -55.3 -78.25 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 62' ' ' ALA . 15.8 m -55.25 -45.75 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.433 1.015 . . . . 0.0 113.179 -174.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -57.64 -45.42 85.49 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.755 -1.215 . . . . 0.0 112.539 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . 0.319 8.1 t-20 -57.26 -31.25 65.39 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 164.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.1 mt -61.81 -28.64 69.61 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.709 1.14 . . . . 0.0 113.647 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -84.94 -31.66 23.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.081 1.352 . . . . 0.0 114.191 174.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.495 1.518 . . . . 0.0 112.731 177.436 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 N--CA 1.483 0.912 0 N-CA-C 109.245 -1.098 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.1 m -107.53 1.28 23.27 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -129.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -179.09 162.82 29.98 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.222 0.915 . . . . 0.0 113.154 170.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -68.5 10.22 0.27 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -125.32 123.7 25.17 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.901 1.28 . . . . 0.0 110.224 -166.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.16 -25.59 57.93 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.132 2.555 . . . . 0.0 115.366 -168.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.742 HG13 ' HG2' ' A' ' 55' ' ' LYS . 46.1 t -53.87 -53.65 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.26 0.936 . . . . 0.0 109.208 173.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.3 ttt -55.53 -41.05 72.64 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.352 1.861 . . . . 0.0 114.728 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.1 mt -62.2 -59.21 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.789 1.635 . . . . 0.0 112.727 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -55.48 -35.97 66.11 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.622 0.769 . . . . 0.0 112.426 177.953 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -55.54 -58.37 8.05 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.954 1.702 . . . . 0.0 112.945 162.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.45 -49.69 71.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.038 -1.664 . . . . 0.0 113.317 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.432 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 8.0 mt -55.91 -42.38 75.94 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 170.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 11.12 80.05 0.06 OUTLIER Pre-proline 0 N--CA 1.49 1.526 0 C-N-CA 129.158 2.983 . . . . 0.0 115.321 -175.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -68.97 -173.18 0.57 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.612 2.208 . . . . 0.0 110.516 161.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -71.36 39.9 0.59 Allowed Glycine 0 CA--C 1.541 1.682 0 C-N-CA 125.202 1.382 . . . . 0.0 115.168 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -78.6 163.31 25.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.655 1.582 . . . . 0.0 112.968 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -135.54 135.95 40.77 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.557 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -104.37 135.55 45.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.033 1.333 . . . . 0.0 111.046 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.52 135.91 50.45 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 129.415 3.086 . . . . 0.0 110.367 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -104.32 128.21 52.09 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 122.66 1.219 . . . . 0.0 109.984 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.8 mp -135.03 135.74 41.56 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 129.244 3.018 . . . . 0.0 106.599 -170.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -67.31 -38.69 85.35 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -160.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -145.24 -49.08 0.24 Allowed 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 124.842 3.474 . . . . 0.0 110.099 -43.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.1 t -71.85 33.25 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 128.253 2.621 . . . . 0.0 114.356 -173.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -178.58 14.31 0.03 OUTLIER Glycine 0 CA--C 1.53 1.019 0 O-C-N 120.533 -1.355 . . . . 0.0 114.788 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -61.2 -10.81 7.28 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 118.884 1.342 . . . . 0.0 114.434 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 65.7 p -63.56 -18.4 63.82 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.371 1.869 . . . . 0.0 115.094 168.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 135.44 -32.19 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.432 1 C-N-CA 132.5 4.32 . . . . 0.0 110.519 -179.462 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.92 46.99 0.14 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 126.171 1.788 . . . . 0.0 113.581 178.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -43.99 122.65 2.95 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 128.534 2.734 . . . . 0.0 115.582 -161.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.1 m -134.52 135.78 42.6 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.713 2.005 . . . . 0.0 107.194 167.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -103.34 135.84 44.23 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 177.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.0 t -110.14 122.45 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 CA-C-N 113.384 -1.735 . . . . 0.0 106.793 -169.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 69.0 mmm -113.62 128.79 56.56 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 172.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -131.7 135.14 46.62 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.681 0.613 . . . . 0.0 110.185 -175.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -127.48 135.75 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 121.03 -1.044 . . . . 0.0 110.37 -167.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.16 118.26 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 105.115 -2.179 . . . . 0.0 105.115 168.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -118.69 -35.95 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.349 -159.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -131.26 -13.6 3.45 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.265 . . . . 0.0 113.884 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.33 -17.19 29.07 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 123.905 0.764 . . . . 0.0 112.096 -147.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -104.69 158.92 16.17 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 125.231 1.412 . . . . 0.0 110.747 163.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -135.08 141.09 46.0 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.043 1.737 . . . . 0.0 111.581 -161.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -134.99 127.54 30.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.977 1.311 . . . . 0.0 111.62 -171.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -99.23 135.17 41.02 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.215 1.806 . . . . 0.0 109.251 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.05 115.96 1.48 Allowed Glycine 0 CA--C 1.525 0.669 0 O-C-N 121.65 -0.656 . . . . 0.0 113.381 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.7 p -104.89 104.73 14.54 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.18 1.392 . . . . 0.0 111.533 -174.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.4 ' HA3' ' N ' ' A' ' 54' ' ' ALA . . . -135.95 147.27 19.12 Favored Glycine 0 CA--C 1.528 0.906 0 N-CA-C 116.266 1.266 . . . . 0.0 116.266 -173.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -47.91 -26.33 1.67 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -152.83 -174.26 4.86 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.824 1.25 . . . . 0.0 109.344 149.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.433 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 6.6 mtmp? -42.36 -38.92 1.99 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 126.522 1.929 . . . . 0.0 114.234 172.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -45.61 -30.09 1.41 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.482 1.913 . . . . 0.0 115.52 171.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.5 tp -122.28 -36.49 2.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 111.466 -175.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.433 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.72 -56.31 22.02 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.39 1.476 . . . . 0.0 112.154 170.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.742 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.2 ttmt -55.02 -46.08 75.22 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 117.228 -1.368 . . . . 0.0 109.425 169.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -49.19 72.85 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 120.664 1.574 . . . . 0.0 113.064 -179.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -55.35 -57.36 12.17 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.824 0.849 . . . . 0.0 113.209 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.47 66.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.308 0.643 . . . . 0.0 112.325 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.39 -53.77 49.55 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.969 2.508 . . . . 0.0 113.372 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -55.3 -51.44 66.68 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.149 1.34 . . . . 0.0 111.389 176.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.2 m -55.38 -49.34 72.57 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.598 1.159 . . . . 0.0 112.115 177.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.44 ' O ' HG23 ' A' ' 66' ' ' VAL . . . -55.19 -65.7 0.54 Allowed 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.393 1.477 . . . . 0.0 111.477 170.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -37.47 -57.71 0.91 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.704 2.002 . . . . 0.0 111.988 177.388 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.12 -62.55 1.59 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 m -55.45 -54.17 47.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 62' ' ' ALA . 49.8 t -55.02 -62.98 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 127.391 2.276 . . . . 0.0 109.733 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.432 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 2.7 m-30 -57.29 -42.14 81.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.78 -38.66 70.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.839 0.856 . . . . 0.0 112.448 170.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.0 -62.94 1.5 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.124 0.969 . . . . 0.0 109.9 165.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -177.96 168.71 2.03 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.993 2.517 . . . . 0.0 112.668 161.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 pt? . . . . . 0 C--O 1.252 1.227 0 C-N-CA 126.682 1.993 . . . . 0.0 111.958 164.078 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo . . . . . 0 N--CA 1.486 1.045 0 N-CA-C 112.745 0.248 . . . . 0.0 112.745 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.6 m -73.25 51.08 0.31 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.577 1.951 . . . . 0.0 114.944 -174.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -155.78 161.78 30.84 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 125.488 1.518 . . . . 0.0 112.486 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 49.5 tttt 43.01 -103.7 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.264 1.826 . . . . 0.0 111.771 -167.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -157.71 140.76 10.9 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 127.399 2.279 . . . . 0.0 107.847 166.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.7 -39.52 3.42 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 121.709 1.606 . . . . 0.0 114.01 -170.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.555 HG13 ' HG2' ' A' ' 55' ' ' LYS . 78.3 t -53.82 -54.96 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 122.351 1.072 . . . . 0.0 108.124 171.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 tpt -55.62 -50.38 70.31 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 126.274 1.83 . . . . 0.0 115.816 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 9.6 pt -57.72 -51.15 73.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 120.768 1.622 . . . . 0.0 113.576 167.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.302 0.0 OUTLIER -55.57 -45.02 77.37 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.02 1.282 . . . . 0.0 114.094 179.459 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -55.32 -53.95 49.73 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.998 2.519 . . . . 0.0 112.685 170.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -55.51 -57.06 13.48 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.478 1.111 . . . . 0.0 113.153 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.39 -44.77 76.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.92 1.688 . . . . 0.0 114.769 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 35.43 65.81 1.76 Allowed Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.245 1.818 . . . . 0.0 114.93 -168.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.53 78.53 0.18 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.317 2.678 . . . . 0.0 113.196 168.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.61 27.54 66.34 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 126.362 1.934 . . . . 0.0 115.992 171.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 pp -106.35 158.16 17.08 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 117.318 2.34 . . . . 0.0 117.318 -155.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 135.87 40.02 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 127.691 2.396 . . . . 0.0 113.608 168.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -104.59 135.4 46.06 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.293 1.037 . . . . 0.0 111.437 176.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -104.89 135.65 45.84 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.354 1.862 . . . . 0.0 109.186 164.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -104.64 130.8 52.61 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 122.764 1.268 . . . . 0.0 110.513 170.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.54 151.28 49.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 129.741 3.216 . . . . 0.0 106.025 -172.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 33' ' ' PHE . 67.4 m -115.51 129.46 56.55 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 120.843 -1.16 . . . . 0.0 109.025 149.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -156.56 -61.17 0.1 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 118.163 -1.415 . . . . 0.0 113.132 -168.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.5 t -49.19 138.04 12.94 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.481 1.513 . . . . 0.0 111.297 -175.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 175.62 32.03 0.04 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.465 1.031 . . . . 0.0 113.482 -162.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.23 -73.16 0.52 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.144 1.378 . . . . 0.0 112.213 -164.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.9 t -66.28 -24.74 66.61 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.507 1.123 . . . . 0.0 112.518 167.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -149.52 127.83 12.15 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 128.748 2.819 . . . . 0.0 108.037 -174.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.55 -27.99 69.01 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 116.911 2.189 . . . . 0.0 116.911 -156.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -156.71 126.83 6.43 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.129 0.877 . . . . 0.0 112.605 166.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -135.36 147.05 48.96 Favored 'General case' 0 C--O 1.248 1.0 0 C-N-CA 127.281 2.233 . . . . 0.0 112.924 169.204 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 0.1 OUTLIER -101.48 131.38 47.65 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 177.603 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 25.6 t -108.57 131.63 58.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.909 -160.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.7 mmt -104.7 124.23 49.01 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 169.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.16 134.79 55.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.4 135.81 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.503 -169.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.1 t -104.22 120.6 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.3 t -142.99 134.05 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.91 1.684 . . . . 0.0 108.863 -162.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 t70 56.66 -66.93 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 127.751 2.42 . . . . 0.0 113.854 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.68 19.26 0.06 OUTLIER Glycine 0 CA--C 1.54 1.618 0 C-N-CA 128.576 2.989 . . . . 0.0 111.942 174.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -126.62 176.33 7.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.959 2.504 . . . . 0.0 109.252 -170.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -130.67 134.67 47.13 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.996 0.919 . . . . 0.0 111.901 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -135.0 150.24 50.31 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.416 1.486 . . . . 0.0 111.177 -173.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.23 135.1 30.36 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.474 1.11 . . . . 0.0 111.019 -173.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.79 120.73 2.73 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.731 1.634 . . . . 0.0 111.048 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 p -104.96 104.69 14.48 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.421 1.088 . . . . 0.0 110.47 -176.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.56 135.72 8.03 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 115.044 0.778 . . . . 0.0 115.044 -166.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -62.27 -1.98 0.88 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 170.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -161.2 158.56 27.58 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.561 2.344 . . . . 0.0 108.963 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -55.56 -32.73 63.26 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 121.028 1.74 . . . . 0.0 114.943 170.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -5.32 5.19 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 121.629 2.013 . . . . 0.0 115.247 169.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.7 tp -117.85 -52.44 2.43 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.412 1.885 . . . . 0.0 110.53 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.3 -53.89 50.38 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.372 1.469 . . . . 0.0 112.501 173.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.555 ' HG2' HG13 ' A' ' 7' ' ' VAL . 4.3 ttmt -55.5 -47.79 75.65 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 117.462 -1.256 . . . . 0.0 112.294 168.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -48.51 74.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 120.474 1.488 . . . . 0.0 112.529 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.6 mmm-85 -54.96 -59.47 4.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 129.228 3.011 . . . . 0.0 113.291 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -50.2 70.41 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.924 0.89 . . . . 0.0 112.457 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.93 -52.3 63.39 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 126.245 1.818 . . . . 0.0 112.8 172.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -52.65 -50.47 63.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.941 1.696 . . . . 0.0 111.843 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.2 m -55.33 -55.08 35.66 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.646 1.178 . . . . 0.0 112.193 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.05 -61.12 2.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 112.224 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -44.64 -60.12 2.15 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.791 2.436 . . . . 0.0 111.49 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.29 -53.25 56.35 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 117.886 0.312 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.8 m -55.25 -73.83 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.264 4.9 m -55.66 -47.11 79.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 124.8 1.24 . . . . 0.0 114.081 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -57.15 -47.23 81.69 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -55.45 -38.37 68.94 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.665 1.12 . . . . 0.0 112.946 172.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -60.63 3.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.001 1.32 . . . . 0.0 110.36 167.211 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -172.59 -43.48 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.181 1.792 . . . . 0.0 113.578 161.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 76.5 mt . . . . . 0 C--O 1.252 1.206 0 C-N-CA 127.817 2.447 . . . . 0.0 112.45 -167.527 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 CA--C 1.544 0.989 0 N-CA-C 112.524 0.163 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.6 t -68.74 -49.65 57.09 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.548 1.939 . . . . 0.0 113.507 0.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.35 -1.03 72.63 Favored Glycine 0 CA--C 1.542 1.738 0 C-N-CA 124.522 1.058 . . . . 0.0 114.91 -172.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.8 pttt -152.21 146.03 25.13 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.259 2.224 . . . . 0.0 111.051 -174.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -66.52 152.29 95.06 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.583 1.153 . . . . 0.0 110.904 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.95 -36.53 38.21 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.564 1.509 . . . . 0.0 114.355 -171.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 13.3 t -55.1 -48.76 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -43.35 75.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.04 1.336 . . . . 0.0 114.525 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.5 mt -55.89 -61.06 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.744 1.218 . . . . 0.0 111.517 168.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.258 0.0 OUTLIER -55.27 -37.85 67.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.787 0.803 . . . . 0.0 112.806 -179.194 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -55.4 -56.98 13.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.954 2.102 . . . . 0.0 113.263 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -55.3 -53.33 57.53 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.95 2.1 . . . . 0.0 112.508 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -40.95 72.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.588 2.755 . . . . 0.0 115.078 173.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.331 0.0 OUTLIER 5.42 80.81 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 129.337 3.055 . . . . 0.0 118.055 -168.371 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.05 -175.83 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 124.311 3.341 . . . . 0.0 114.995 163.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.03 83.03 0.07 OUTLIER Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.121 -0.987 . . . . 0.0 111.507 162.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.32 160.7 33.14 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -175.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -135.7 135.78 40.34 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.826 2.05 . . . . 0.0 113.438 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -104.53 135.55 45.73 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.805 1.242 . . . . 0.0 110.668 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -125.99 135.73 52.16 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.91 2.084 . . . . 0.0 109.985 -178.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -104.63 131.47 52.02 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.509 1.147 . . . . 0.0 111.332 -172.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -134.94 135.63 41.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 128.848 2.859 . . . . 0.0 107.342 -175.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 p -85.01 151.17 24.38 Favored 'General case' 0 C--N 1.319 -0.741 0 O-C-N 119.86 -1.775 . . . . 0.0 112.663 159.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.284 5.1 tp10 89.02 52.64 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 116.765 2.135 . . . . 0.0 116.765 142.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.413 ' HB2' HG21 ' A' ' 34' ' ' VAL . 27.7 t -72.72 50.04 0.24 Allowed 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 122.782 1.277 . . . . 0.0 111.158 153.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.47 -177.05 1.32 Allowed Glycine 0 CA--C 1.53 1.02 0 C-N-CA 129.456 3.408 . . . . 0.0 120.559 175.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -120.53 -23.04 6.2 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 113.607 -1.297 . . . . 0.0 114.369 -151.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.1 m -63.03 -14.93 54.14 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 115.867 1.803 . . . . 0.0 115.867 -159.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -153.1 -37.68 0.1 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.439 1.496 . . . . 0.0 111.002 162.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.33 -52.0 11.86 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -173.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? 47.53 88.78 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.358 1.463 . . . . 0.0 110.451 -156.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 54.5 m -104.36 135.29 46.08 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.619 0.723 . . . . 0.0 112.408 -156.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -104.66 135.4 46.13 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 105.315 -2.106 . . . . 0.0 105.315 161.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.413 HG21 ' HB2' ' A' ' 25' ' ' SER . 56.0 t -122.57 115.79 47.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.14 -157.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 82.1 mmm -104.9 117.34 33.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.834 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p -104.88 135.52 46.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.778 177.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.12 135.55 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.673 -0.642 . . . . 0.0 110.207 -172.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.2 t -104.27 116.46 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 169.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 63.1 t -137.67 123.33 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.487 1.515 . . . . 0.0 108.46 -165.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.8 t70 63.88 -29.44 0.1 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 127.244 2.218 . . . . 0.0 116.2 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 139.93 -5.81 2.82 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.555 1.55 . . . . 0.0 113.056 -161.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -104.95 167.92 9.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.101 2.161 . . . . 0.0 110.117 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -134.55 139.11 45.15 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.754 0.822 . . . . 0.0 112.227 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -135.04 158.99 42.93 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.435 1.494 . . . . 0.0 112.161 -176.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -135.45 121.67 20.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.23 1.812 . . . . 0.0 108.983 171.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -114.79 105.25 1.48 Allowed Glycine 0 CA--C 1.52 0.364 0 C-N-CA 126.013 1.768 . . . . 0.0 109.644 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -105.28 104.36 14.08 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.76 0.791 . . . . 0.0 110.126 -170.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.11 136.37 8.38 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.966 1.746 . . . . 0.0 114.36 -169.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -48.35 -26.72 2.17 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.487 ' HB3' ' HE2' ' A' ' 52' ' ' LYS . 20.3 t-20 -150.36 166.29 30.49 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 125.775 1.63 . . . . 0.0 111.072 169.269 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -46.61 -46.84 19.94 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.355 1.434 . . . . 0.0 114.407 -175.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.487 ' HE2' ' HB3' ' A' ' 50' ' ' ASN . 0.0 OUTLIER -58.47 -5.81 0.59 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 116.096 1.887 . . . . 0.0 116.096 175.986 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.6 tp -120.11 -42.89 2.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.296 2.238 . . . . 0.0 110.869 173.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.43 -59.57 4.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.089 1.356 . . . . 0.0 112.507 171.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -55.46 -39.83 70.85 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-O 115.455 -2.212 . . . . 0.0 112.984 164.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.28 -52.1 64.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 123.37 2.805 . . . . 0.0 111.907 178.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.23 -54.29 45.28 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.503 1.921 . . . . 0.0 114.078 169.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -58.37 8.05 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.29 -51.93 13.63 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 125.034 1.334 . . . . 0.0 114.105 167.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -55.13 -51.37 66.64 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.226 1.41 . . . . 0.0 112.052 178.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.2 m -55.28 -53.06 60.82 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.705 1.202 . . . . 0.0 111.831 174.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -61.7 2.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.229 175.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.59 -60.11 2.14 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 127.3 2.24 . . . . 0.0 110.97 178.346 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.05 -52.4 63.31 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.212 0.205 . . . . 0.0 111.495 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 m -55.36 -69.02 0.15 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.297 32.8 m -55.39 -47.13 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -176.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -56.73 -38.53 72.5 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -55.93 -44.97 78.84 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.126 1.33 . . . . 0.0 111.659 171.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.257 3.5 pp -89.71 13.03 15.26 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 175.082 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.333 3.7 p80 71.73 36.18 1.27 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 128.245 2.618 . . . . 0.0 115.632 150.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.996 1.719 . . . . 0.0 113.375 167.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo . . . . . 0 CA--C 1.537 0.658 0 CA-C-O 121.388 0.495 . . . . 0.0 112.72 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t -115.89 23.65 12.09 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.786 2.034 . . . . 0.0 112.285 -164.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.61 44.42 0.11 Allowed Glycine 0 CA--C 1.538 1.488 0 N-CA-C 120.883 3.113 . . . . 0.0 120.883 -159.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -61.43 -25.61 67.33 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.925 1.863 . . . . 0.0 111.991 163.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -144.66 137.61 13.82 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 126.937 2.095 . . . . 0.0 107.629 163.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -61.61 -27.13 81.19 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.15 2.566 . . . . 0.0 114.752 -176.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.479 HG13 ' HG2' ' A' ' 55' ' ' LYS . 74.8 t -55.1 -48.06 76.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.464 0 CA-C-N 118.264 0.484 . . . . 0.0 109.729 176.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.47 -42.53 74.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.913 1.285 . . . . 0.0 114.112 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.425 ' H ' HG13 ' A' ' 9' ' ' ILE . 3.5 mt -55.98 -59.26 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.299 1.04 . . . . 0.0 113.091 167.086 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.27 0.0 OUTLIER -55.4 -37.5 67.67 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.348 0.659 . . . . 0.0 112.062 -179.308 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -55.35 -61.81 2.09 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.461 2.304 . . . . 0.0 112.67 164.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.52 -53.4 56.8 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.187 -0.945 . . . . 0.0 112.343 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.419 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 11.8 mt -56.92 -40.22 75.92 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 171.389 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.42 0.0 OUTLIER 0.91 73.52 0.04 OUTLIER Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 127.831 2.452 . . . . 0.0 117.032 -160.619 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.08 64.06 5.15 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 124.346 3.364 . . . . 0.0 113.864 -173.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.08 27.34 73.72 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.739 1.161 . . . . 0.0 114.843 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -91.66 167.82 11.93 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.749 1.619 . . . . 0.0 113.676 -171.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -135.22 136.47 41.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.456 1.502 . . . . 0.0 113.367 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -104.32 135.4 45.85 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.045 0.938 . . . . 0.0 110.827 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -123.81 120.6 33.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.679 1.992 . . . . 0.0 109.158 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -104.95 131.56 52.3 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.551 1.14 . . . . 0.0 111.787 -167.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.38 168.48 18.51 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 126.669 1.988 . . . . 0.0 106.629 -179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.1 p -150.13 165.23 33.45 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 119.594 -1.941 . . . . 0.0 111.426 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.284 3.1 mp0 75.84 39.3 0.32 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.497 1.919 . . . . 0.0 113.015 177.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -62.26 -4.0 1.58 Allowed 'General case' 0 CA--C 1.553 1.091 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.798 152.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -169.04 161.13 34.77 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 127.262 2.363 . . . . 0.0 110.399 174.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -140.61 154.2 46.36 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.997 1.319 . . . . 0.0 111.027 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 29' ' ' HIS . 51.5 m 5.32 83.19 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 129.786 3.234 . . . . 0.0 115.464 163.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 28' ' ' SER . 66.4 m80 -112.39 6.39 18.68 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 128.994 2.918 . . . . 0.0 114.407 17.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.09 1.2 11.63 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.017 1.327 . . . . 0.0 113.889 171.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 48.4 tptt -27.85 104.27 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 128.833 2.853 . . . . 0.0 114.847 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 71.1 m -135.36 135.22 40.53 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.519 1.128 . . . . 0.0 112.661 -172.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -104.59 135.88 45.18 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 127.84 2.456 . . . . 0.0 107.868 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.49 129.29 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-O 122.931 1.348 . . . . 0.0 114.507 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.29 125.38 53.82 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 120.678 -1.264 . . . . 0.0 110.154 -176.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.5 p -114.5 142.74 46.01 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 124.351 1.061 . . . . 0.0 111.708 177.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.18 135.94 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 120.891 -1.131 . . . . 0.0 110.973 -175.389 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.18 118.28 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 170.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -132.92 -33.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -158.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -137.59 13.35 2.97 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 122.221 1.01 . . . . 0.0 113.484 -160.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.29 -11.25 31.44 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -153.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -105.15 164.29 11.93 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 128.219 2.608 . . . . 0.0 110.862 175.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -129.83 138.68 51.13 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.301 1.84 . . . . 0.0 109.811 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -132.51 152.94 51.39 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.658 1.583 . . . . 0.0 109.194 -174.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -140.68 135.27 31.47 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.236 1.014 . . . . 0.0 111.178 173.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.66 122.79 4.67 Favored Glycine 0 CA--C 1.523 0.566 0 C-N-CA 126.519 2.009 . . . . 0.0 111.284 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 t -104.91 119.69 39.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.78 0.832 . . . . 0.0 110.549 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.28 149.14 20.82 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 125.104 1.335 . . . . 0.0 116.06 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -48.98 -26.16 2.37 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 175.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -161.15 -176.27 5.35 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.11 1.764 . . . . 0.0 108.78 152.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 28.5 mtmm -45.76 -38.66 7.27 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.943 2.097 . . . . 0.0 115.33 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -16.13 4.38 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 173.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.4 tp -123.38 -40.41 2.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.149 2.18 . . . . 0.0 111.786 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.69 -57.64 11.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.103 1.361 . . . . 0.0 112.291 171.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.479 ' HG2' HG13 ' A' ' 7' ' ' VAL . 8.6 ttmt -55.14 -45.82 75.65 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-O 116.61 -1.662 . . . . 0.0 109.376 169.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.44 75.44 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 121.994 2.179 . . . . 0.0 113.441 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -55.51 -57.82 10.31 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.815 0.846 . . . . 0.0 112.858 170.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.36 -52.27 64.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.082 0.953 . . . . 0.0 112.164 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.06 -58.37 6.76 Favored 'General case' 0 C--O 1.215 -0.723 0 C-N-CA 128.247 2.619 . . . . 0.0 111.978 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.04 -47.43 74.79 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 120.133 1.333 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 m -55.29 -55.63 29.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.22 1.008 . . . . 0.0 112.141 175.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -53.28 58.02 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.809 1.244 . . . . 0.0 112.839 173.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.87 -61.66 1.85 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 128.055 2.542 . . . . 0.0 110.325 176.55 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.31 -46.29 72.79 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 122.93 0.492 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.4 m -55.14 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.552 0.741 . . . . 0.0 112.767 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.0 m -55.45 -40.0 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -176.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.419 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 4.7 m-30 -59.84 -43.76 94.44 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 113.959 172.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -35.37 65.92 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.258 1.39 . . . . 0.0 113.811 163.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt -71.2 -20.04 62.32 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 119.324 0.966 . . . . 0.0 113.334 170.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.253 10.9 m-70 76.82 44.0 0.12 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.598 2.759 . . . . 0.0 112.574 -178.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 C--O 1.247 0.959 0 C-N-CA 127.503 2.321 . . . . 0.0 111.276 178.676 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo . . . . . 0 CA--C 1.539 0.733 0 CA-C-O 121.823 0.676 . . . . 0.0 112.867 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.6 p -65.71 -24.48 66.99 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.531 1.932 . . . . 0.0 115.149 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 165.35 -176.04 41.03 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.402 1.001 . . . . 0.0 114.092 175.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -70.17 -24.83 63.21 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.753 1.221 . . . . 0.0 113.481 175.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -56.76 119.36 29.17 Favored Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.916 1.286 . . . . 0.0 111.207 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.87 -36.86 5.62 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 121.964 1.776 . . . . 0.0 113.901 -173.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 55' ' ' LYS . 93.5 t -52.76 -55.01 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 122.664 1.221 . . . . 0.0 108.88 173.246 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.2 tpt -55.79 -51.49 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 10.4 pt -55.67 -47.71 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 166.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.283 0.0 OUTLIER -55.63 -43.1 75.85 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.08 -54.59 41.2 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 112.031 172.027 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.53 -64.14 0.94 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.428 1.891 . . . . 0.0 112.739 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.281 50.6 mt -56.08 -25.21 44.45 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 116.369 1.989 . . . . 0.0 116.369 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER 22.64 61.38 0.33 Allowed Pre-proline 0 N--CA 1.491 1.583 0 C-N-CA 129.038 2.935 . . . . 0.0 116.495 -178.264 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.44 39.59 0.42 Allowed 'Trans proline' 0 CA--C 1.555 1.56 1 C-N-CA 125.416 4.078 . . . . 0.0 117.169 -160.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.66 32.22 13.79 Favored Glycine 0 CA--C 1.534 1.256 0 O-C-N 120.266 -1.521 . . . . 0.0 113.737 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.31 171.58 7.29 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -169.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -135.33 140.25 44.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.621 2.369 . . . . 0.0 111.513 160.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.4 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 27.2 m-85 -104.42 135.43 45.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.415 1.086 . . . . 0.0 110.841 176.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -128.9 127.67 42.26 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.565 1.546 . . . . 0.0 109.409 176.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -105.35 131.24 53.04 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.506 1.122 . . . . 0.0 111.707 -170.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.23 170.16 15.84 Favored 'General case' 0 N--CA 1.44 -0.953 0 C-N-CA 127.917 2.487 . . . . 0.0 105.584 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -147.59 169.83 18.79 Favored 'General case' 0 C--N 1.315 -0.934 0 O-C-N 119.533 -1.979 . . . . 0.0 110.56 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.255 16.3 mm-40 103.71 12.98 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 128.29 2.636 . . . . 0.0 113.094 161.434 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.8 t -55.98 170.87 0.28 Allowed 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 121.891 0.853 . . . . 0.0 110.745 152.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -167.06 37.82 0.24 Allowed Glycine 0 CA--C 1.532 1.144 0 C-N-CA 125.322 1.439 . . . . 0.0 111.886 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.51 -23.93 28.92 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 -168.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.9 t -142.68 2.77 1.42 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 174.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -157.4 167.86 29.02 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.813 -1.18 . . . . 0.0 112.282 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.18 -20.57 10.83 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.395 1.878 . . . . 0.0 115.91 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? -147.86 141.59 25.65 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 168.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 t -135.56 136.25 40.97 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 128.285 2.634 . . . . 0.0 111.072 171.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -103.97 135.44 45.49 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 175.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.65 135.12 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-O 123.775 1.75 . . . . 0.0 114.77 -169.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.89 130.36 56.8 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.267 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 p -119.31 135.64 54.62 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.06 0.944 . . . . 0.0 111.437 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.4 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 2.3 m -122.15 135.69 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.01 0.924 . . . . 0.0 111.534 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.7 t -104.39 127.1 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 165.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.8 p -148.32 148.68 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.429 1.491 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 t70 60.19 -66.4 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 127.452 2.301 . . . . 0.0 114.258 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -173.01 19.14 0.06 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 128.245 2.831 . . . . 0.0 112.396 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -135.27 167.37 21.14 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.576 2.35 . . . . 0.0 111.66 -168.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -134.95 136.73 42.47 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.627 1.171 . . . . 0.0 112.391 -165.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -135.09 153.92 51.86 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.898 1.679 . . . . 0.0 110.936 -175.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -137.95 135.17 35.77 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.857 1.263 . . . . 0.0 111.889 -178.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.69 106.6 0.63 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 127.368 2.413 . . . . 0.0 111.464 -172.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 p -104.74 114.55 28.83 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.695 1.247 . . . . 0.0 110.72 -177.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.97 143.23 14.65 Favored Glycine 0 CA--C 1.528 0.881 0 CA-C-N 114.412 -1.267 . . . . 0.0 115.562 -170.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -30.05 -53.47 0.16 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 125.573 1.549 . . . . 0.0 114.546 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -137.94 -175.59 4.14 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.81 1.244 . . . . 0.0 110.593 159.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.458 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 95.4 mttt -45.28 -43.66 10.73 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.185 1.394 . . . . 0.0 114.479 177.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.04 -17.17 2.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 115.835 1.791 . . . . 0.0 115.835 177.244 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.4 tp -115.41 -38.48 3.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.196 1.798 . . . . 0.0 111.254 174.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.47 -54.62 41.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.514 1.126 . . . . 0.0 112.079 173.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.506 ' HB3' HG22 ' A' ' 7' ' ' VAL . 15.3 mmtt -55.19 -44.05 74.96 Favored 'General case' 0 C--O 1.204 -1.32 0 CA-C-O 114.91 -2.472 . . . . 0.0 112.457 162.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -47.69 75.28 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 124.324 3.238 . . . . 0.0 111.474 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -55.39 -62.85 1.4 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.452 1.901 . . . . 0.0 112.728 171.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.1 -55.72 27.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.262 1.425 . . . . 0.0 112.559 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -42.37 -63.92 0.68 Allowed 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 125.592 1.557 . . . . 0.0 114.21 165.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -45.32 75.76 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.832 1.651 . . . . 0.0 111.606 -176.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 m -55.23 -57.73 10.58 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.307 0.643 . . . . 0.0 112.296 175.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.489 ' O ' HG22 ' A' ' 66' ' ' VAL . . . -55.18 -50.87 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.287 1.035 . . . . 0.0 112.503 175.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -60.56 3.12 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.51 1.924 . . . . 0.0 111.164 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.39 -47.59 69.39 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.076 0.398 . . . . 0.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 37.6 m -55.35 -71.19 0.09 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 173.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.489 HG22 ' O ' ' A' ' 62' ' ' ALA . 18.9 m -55.22 -39.93 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.281 0.946 . . . . 0.0 113.43 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -56.32 -46.01 80.07 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.845 -1.159 . . . . 0.0 113.993 170.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -34.97 65.59 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 165.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 20.1 mt -69.76 -29.23 66.52 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 119.296 0.953 . . . . 0.0 112.73 170.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.291 17.6 m-70 92.46 37.85 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 130.583 3.553 . . . . 0.0 114.008 175.139 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 N--CA 1.482 1.147 0 C-N-CA 125.181 1.392 . . . . 0.0 114.488 171.256 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo . . . . . 0 CA--C 1.542 0.898 0 N-CA-C 112.432 0.128 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.3 p -149.17 28.35 0.82 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 127.852 2.461 . . . . 0.0 113.286 1.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 82.69 -90.02 1.51 Allowed Glycine 0 CA--C 1.527 0.795 0 C-N-CA 124.859 1.219 . . . . 0.0 113.419 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 58.7 -24.63 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 127.973 2.509 . . . . 0.0 115.206 -164.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -139.56 155.73 71.62 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 127.473 2.309 . . . . 0.0 109.605 167.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -66.34 -37.21 24.64 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.7 2.267 . . . . 0.0 115.161 -175.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.5 t -52.08 -49.69 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.085 0.554 . . . . 0.0 109.616 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -55.56 -51.81 65.85 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 179.223 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.411 ' H ' HG13 ' A' ' 9' ' ' ILE . 5.0 mt -55.75 -51.19 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.643 1.11 . . . . 0.0 111.884 174.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.86 -51.44 63.61 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.561 1.144 . . . . 0.0 109.876 176.06 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -55.73 -52.37 64.16 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.127 1.771 . . . . 0.0 112.444 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -55.35 -60.08 3.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.044 2.138 . . . . 0.0 113.58 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.4 mt -55.89 -39.33 71.42 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 30.97 65.6 0.93 Allowed Pre-proline 0 N--CA 1.487 1.404 0 C-N-CA 128.048 2.539 . . . . 0.0 115.495 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -64.59 -34.05 53.59 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.144 2.563 . . . . 0.0 114.435 -167.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.99 25.05 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.693 1.616 . . . . 0.0 113.335 177.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.446 ' CD2' HG22 ' A' ' 39' ' ' VAL . 37.3 mt -58.92 136.27 57.82 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 126.58 1.952 . . . . 0.0 114.866 -165.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -135.08 135.93 41.63 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.629 1.572 . . . . 0.0 110.363 147.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.405 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 20.1 m-85 -104.67 135.28 46.36 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.664 1.228 . . . . 0.0 110.735 -178.276 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.68 135.59 55.08 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 128.017 2.527 . . . . 0.0 109.101 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -104.79 126.05 51.47 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 122.831 1.3 . . . . 0.0 111.618 -175.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.64 145.84 51.4 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 130.928 3.691 . . . . 0.0 105.631 -176.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -131.07 67.29 1.52 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 119.399 -2.063 . . . . 0.0 110.344 -172.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -139.43 -52.25 0.54 Allowed 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.337 -1.477 . . . . 0.0 114.336 -129.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.4 t -69.04 -178.72 1.31 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.665 1.186 . . . . 0.0 111.183 170.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.02 169.71 42.42 Favored Glycine 0 CA--C 1.528 0.863 0 O-C-N 120.821 -1.175 . . . . 0.0 114.981 174.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -145.8 149.98 35.34 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.996 2.118 . . . . 0.0 107.312 168.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.9 m -41.77 -9.31 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 131.27 3.828 . . . . 0.0 121.21 -150.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -147.42 74.94 1.34 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.774 1.63 . . . . 0.0 110.53 169.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -150.07 -4.92 0.35 Allowed 'General case' 0 CA--C 1.558 1.284 0 O-C-N 117.707 -3.121 . . . . 0.0 114.504 -1.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -150.59 152.35 33.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.934 1.294 . . . . 0.0 113.182 -163.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.8 m -135.06 135.5 41.32 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 127.98 2.512 . . . . 0.0 109.788 171.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 21.4 m-30 -95.48 130.71 42.21 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 -178.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -108.58 116.38 51.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 113.493 -1.685 . . . . 0.0 107.406 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 11.8 mmt -104.71 123.8 48.25 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 m -123.13 135.06 54.19 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.405 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 1.8 m -127.91 135.43 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.054 0.942 . . . . 0.0 111.989 -169.2 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.7 t -104.36 125.26 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 167.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.446 HG22 ' CD2' ' A' ' 17' ' ' LEU . 94.3 t -135.36 -33.86 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -158.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -149.21 26.48 0.87 Allowed 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 122.408 1.099 . . . . 0.0 111.566 -160.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.23 -15.44 8.9 Favored Glycine 0 CA--C 1.538 1.474 0 O-C-N 120.797 -1.189 . . . . 0.0 112.873 -161.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -112.1 168.76 9.35 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.769 2.027 . . . . 0.0 112.252 175.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -133.48 140.23 47.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.585 1.954 . . . . 0.0 111.106 -163.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.97 155.25 51.07 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.945 1.698 . . . . 0.0 110.762 -175.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -132.74 135.08 45.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.285 1.034 . . . . 0.0 110.581 -176.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.01 109.24 0.85 Allowed Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.106 1.336 . . . . 0.0 112.522 -166.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.7 p -104.78 104.63 14.45 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.019 0.909 . . . . 0.0 112.245 -168.363 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.17 135.93 7.62 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 116.139 1.215 . . . . 0.0 116.139 -176.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -50.46 -23.8 2.69 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -149.34 176.94 10.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.268 1.027 . . . . 0.0 110.831 157.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -47.11 -48.35 22.99 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 125.897 1.679 . . . . 0.0 114.444 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.23 -9.41 0.65 Allowed 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 176.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.8 tp -117.56 -41.73 2.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.808 2.043 . . . . 0.0 110.798 172.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.63 -59.52 4.73 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.647 1.579 . . . . 0.0 113.036 173.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -55.46 -41.58 73.12 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 115.667 -2.111 . . . . 0.0 112.532 164.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -48.97 73.22 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 122.719 2.508 . . . . 0.0 111.19 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -55.32 -58.82 6.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.728 2.011 . . . . 0.0 115.343 163.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.38 -53.71 52.86 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.766 1.166 . . . . 0.0 111.889 -176.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -40.58 -72.84 0.06 Allowed 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 117.525 -1.226 . . . . 0.0 113.634 156.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -45.27 -46.32 12.56 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.175 1.807 . . . . 0.0 113.796 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.4 m -55.27 -63.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.881 1.272 . . . . 0.0 112.895 170.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.34 -59.58 4.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.078 0.951 . . . . 0.0 112.81 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -45.27 -63.34 0.96 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.779 3.231 . . . . 0.0 111.226 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.21 -45.02 75.9 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 175.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 85.5 m -55.33 -68.46 0.19 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.583 0.629 . . . . 0.0 112.359 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.4 m -55.29 -35.32 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.409 1.004 . . . . 0.0 113.125 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -63.73 -40.56 97.03 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.616 -1.303 . . . . 0.0 114.115 175.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -55.41 -39.32 70.07 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 118.926 0.785 . . . . 0.0 112.503 162.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.0 mt -76.84 1.27 17.92 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 170.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.279 0.9 OUTLIER 70.73 24.09 4.37 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.296 1.838 . . . . 0.0 113.993 157.576 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.7 mt . . . . . 0 C--O 1.252 1.235 0 C-N-CA 127.842 2.457 . . . . 0.0 112.725 -176.12 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo . . . . . 0 CA--C 1.544 0.979 0 N-CA-C 113.189 0.419 . . . . 0.0 113.189 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 m -64.95 -12.97 55.71 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 129.338 3.055 . . . . 0.0 115.455 4.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -148.78 -164.28 11.41 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 125.806 1.67 . . . . 0.0 112.364 174.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -143.48 -44.46 0.28 Allowed 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.699 2.0 . . . . 0.0 110.588 177.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -147.02 143.53 18.44 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 127.388 2.275 . . . . 0.0 106.192 145.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.9 -30.79 10.81 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 CA-C-N 121.158 1.449 . . . . 0.0 114.962 -171.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.676 HG13 ' HG2' ' A' ' 55' ' ' LYS . 15.2 t -55.44 -52.98 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.666 1.121 . . . . 0.0 109.287 160.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.49 -48.93 73.81 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -176.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.4 pt -60.13 -49.68 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.586 1.085 . . . . 0.0 111.805 169.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.348 0.0 OUTLIER -55.94 -39.37 71.6 Favored 'General case' 0 N--CA 1.461 0.094 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 177.666 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -55.54 -60.2 3.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.619 1.968 . . . . 0.0 109.426 169.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -55.2 -59.2 5.11 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.438 1.495 . . . . 0.0 113.999 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.6 mt -55.73 -45.27 78.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.157 1.783 . . . . 0.0 115.619 171.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 34.83 65.85 1.58 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 127.051 2.14 . . . . 0.0 115.3 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.64 33.91 0.09 OUTLIER 'Trans proline' 0 CA--C 1.557 1.659 1 C-N-CA 125.814 4.342 . . . . 0.0 118.452 -175.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 10.93 85.36 Favored Glycine 0 CA--C 1.539 1.587 0 O-C-N 119.762 -1.836 . . . . 0.0 114.351 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.22 164.0 4.53 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.304 2.241 . . . . 0.0 115.337 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.07 139.49 44.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.79 2.036 . . . . 0.0 111.818 164.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -104.56 135.37 46.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.276 1.03 . . . . 0.0 112.376 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -118.71 135.17 54.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.498 2.319 . . . . 0.0 109.241 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -112.37 129.23 56.38 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 122.315 1.055 . . . . 0.0 112.146 -174.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.74 150.99 51.49 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 129.75 3.22 . . . . 0.0 108.392 -171.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.6 p -118.62 126.93 53.03 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 126.777 2.031 . . . . 0.0 113.977 -169.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.358 0.8 OUTLIER 69.61 43.82 0.95 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 123.515 1.626 . . . . 0.0 114.749 147.828 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.459 ' CB ' HG21 ' A' ' 34' ' ' VAL . 7.4 t -70.15 -2.15 12.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 129.292 3.037 . . . . 0.0 115.794 175.326 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.67 25.26 4.49 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 116.718 1.447 . . . . 0.0 116.718 -151.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.89 -23.34 67.31 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.894 1.847 . . . . 0.0 113.555 -177.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 p -68.83 -16.45 63.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.504 1.922 . . . . 0.0 114.385 170.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -153.28 51.11 0.72 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.791 2.036 . . . . 0.0 110.587 -175.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.406 ' HA ' ' HA ' ' A' ' 31' ' ' LYS . . . -38.33 118.37 0.71 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.682 1.993 . . . . 0.0 114.039 -165.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 30' ' ' ALA . 4.1 mmtm -128.06 165.54 20.14 Favored 'General case' 0 N--CA 1.479 0.995 1 C-N-CA 132.387 4.275 . . . . 0.0 110.702 10.735 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.9 m -135.26 106.68 6.83 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 164.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -87.5 136.85 32.78 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 102.654 -3.091 . . . . 0.0 102.654 156.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . 0.459 HG21 ' CB ' ' A' ' 25' ' ' SER . 19.1 t -124.1 130.03 73.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 123.197 1.475 . . . . 0.0 109.302 -157.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.5 mmm -118.29 135.34 54.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 113.52 -1.673 . . . . 0.0 108.799 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.5 m -125.19 135.46 52.62 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.508 0.723 . . . . 0.0 110.197 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.6 m -117.86 135.92 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.251 1.021 . . . . 0.0 111.992 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.5 t -104.2 126.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 164.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.7 p -151.66 149.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.693 1.197 . . . . 0.0 110.347 -178.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 55.8 -69.85 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.32 2.248 . . . . 0.0 114.112 -168.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.02 21.88 0.08 OUTLIER Glycine 0 CA--C 1.537 1.451 0 C-N-CA 128.396 2.903 . . . . 0.0 111.794 173.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -128.55 162.43 27.27 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.441 2.296 . . . . 0.0 109.878 -167.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -132.81 133.66 43.66 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.95 1.3 . . . . 0.0 111.626 -173.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -135.11 141.5 46.03 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.608 1.163 . . . . 0.0 110.741 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -118.16 135.04 54.48 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.337 1.855 . . . . 0.0 109.976 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.82 132.7 6.55 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.625 1.107 . . . . 0.0 112.556 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -128.03 104.65 7.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.748 0.785 . . . . 0.0 111.719 -164.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.96 140.56 11.68 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 125.49 1.519 . . . . 0.0 115.161 -163.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -47.37 -27.68 1.74 Allowed 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 116.074 1.879 . . . . 0.0 116.074 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -154.97 174.75 14.72 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 126.639 1.976 . . . . 0.0 109.498 162.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -53.11 -31.78 43.89 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 127.393 2.277 . . . . 0.0 115.982 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -13.9 7.78 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 121.226 1.83 . . . . 0.0 115.127 167.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.35 -50.79 2.72 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.209 2.204 . . . . 0.0 110.264 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -52.56 63.19 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.377 -1.452 . . . . 0.0 112.962 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.676 ' HG2' HG13 ' A' ' 7' ' ' VAL . 4.9 ttmt -55.14 -48.41 73.73 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-O 117.23 -1.367 . . . . 0.0 109.444 169.098 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.06 72.37 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 120.561 1.528 . . . . 0.0 113.675 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -55.31 -60.95 2.69 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.574 1.149 . . . . 0.0 112.178 172.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -50.87 68.51 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.252 1.021 . . . . 0.0 112.207 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.67 -66.98 0.29 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 126.517 1.927 . . . . 0.0 111.904 171.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -55.45 -38.49 69.12 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.257 0.935 . . . . 0.0 112.942 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 t -55.33 -59.72 4.41 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.872 0.869 . . . . 0.0 113.167 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.14 -56.39 20.43 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.122 1.369 . . . . 0.0 112.672 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.404 ' HG ' ' CZ ' ' A' ' 67' ' ' PHE . 0.6 OUTLIER -43.54 -61.49 1.37 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 111.458 172.622 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.24 -49.25 67.22 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.809 0.731 . . . . 0.0 111.165 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 35.9 m -55.29 -73.38 0.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 173.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.273 34.0 m -55.51 -44.39 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.404 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 7.6 m-30 -56.38 -48.88 75.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 171.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.86 -37.06 68.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 120.212 1.369 . . . . 0.0 113.696 169.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.39 -39.62 91.36 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.582 1.153 . . . . 0.0 111.655 168.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.295 20.4 m-70 98.08 44.72 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 131.062 3.745 . . . . 0.0 112.538 177.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.25 1.094 0 C-N-CA 127.187 2.195 . . . . 0.0 110.87 178.68 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo . . . . . 0 N--CA 1.489 1.241 0 CA-C-O 119.028 -0.488 . . . . 0.0 112.816 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.1 p -140.92 -58.63 0.51 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.649 1.18 . . . . 0.0 112.963 -173.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -65.44 -16.61 63.16 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.997 1.284 . . . . 0.0 113.827 168.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -132.52 95.13 3.55 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.556 2.342 . . . . 0.0 108.369 166.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -153.4 132.3 6.85 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.522 1.529 . . . . 0.0 109.124 -175.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.49 -36.11 27.61 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 121.474 1.449 . . . . 0.0 113.54 -174.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.573 HG13 ' HG2' ' A' ' 55' ' ' LYS . 78.5 t -53.87 -51.76 41.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.03 -49.13 72.33 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -177.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.64 -58.18 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.218 1.007 . . . . 0.0 111.371 174.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.439 ' HB2' HD13 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -55.06 -46.36 75.37 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.453 1.101 . . . . 0.0 111.635 179.793 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -55.56 -57.29 12.54 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.271 1.828 . . . . 0.0 112.427 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -55.85 -53.16 60.08 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.708 1.603 . . . . 0.0 113.174 175.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.46 -34.97 64.98 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.069 1.348 . . . . 0.0 113.488 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 35.8 54.11 2.22 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 127.161 2.184 . . . . 0.0 115.245 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -73.21 58.53 3.6 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 124.71 3.607 . . . . 0.0 115.227 -167.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.42 17.89 78.0 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.513 1.53 . . . . 0.0 114.84 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -81.62 174.1 11.72 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -172.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -134.97 143.06 46.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 127.127 2.171 . . . . 0.0 110.309 157.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -104.32 129.64 52.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 124.664 1.228 . . . . 0.0 109.584 172.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.72 135.18 51.71 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 127.69 2.396 . . . . 0.0 108.482 177.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -109.77 125.63 52.9 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 123.144 1.45 . . . . 0.0 111.701 -176.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 mp -135.09 157.09 47.82 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 131.319 3.847 . . . . 0.0 105.826 -173.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 m -149.66 102.09 3.13 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 119.317 -2.114 . . . . 0.0 110.144 169.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.45 -18.12 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 120.385 3.476 . . . . 0.0 120.385 -174.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -72.45 34.56 0.07 Allowed 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 116.064 1.875 . . . . 0.0 116.064 -169.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 176.43 27.42 0.03 OUTLIER Glycine 0 N--CA 1.472 1.076 0 N-CA-C 118.319 2.088 . . . . 0.0 118.319 -173.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -60.55 -34.95 74.9 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.185 1.993 . . . . 0.0 114.333 -173.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.9 t -72.0 -6.45 42.29 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.884 1.274 . . . . 0.0 113.594 176.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -143.76 52.37 1.32 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.197 2.199 . . . . 0.0 109.551 175.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.0 141.18 6.19 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.24 1.816 . . . . 0.0 115.512 -161.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -135.82 137.24 41.35 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 129.888 3.275 . . . . 0.0 110.819 4.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.7 m -104.76 125.79 51.19 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 122.453 1.12 . . . . 0.0 111.116 175.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -104.35 133.45 49.23 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 104.604 -2.369 . . . . 0.0 104.604 174.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -118.65 117.74 55.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 123.046 1.403 . . . . 0.0 110.561 -168.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.2 mmm -105.33 126.06 51.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.733 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.7 m -116.71 135.5 53.72 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 123.652 0.781 . . . . 0.0 110.125 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 m -119.48 135.91 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.954 0.902 . . . . 0.0 111.702 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 87.8 t -104.11 127.79 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 160.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.1 p -148.85 146.93 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.825 1.65 . . . . 0.0 109.321 -174.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.6 t70 59.07 -67.22 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.944 2.098 . . . . 0.0 114.668 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 19.47 0.07 OUTLIER Glycine 0 CA--C 1.541 1.719 0 C-N-CA 128.528 2.966 . . . . 0.0 112.798 169.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -135.12 165.04 26.3 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.721 2.408 . . . . 0.0 111.667 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -133.92 137.39 44.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.538 1.135 . . . . 0.0 112.779 -167.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -135.13 157.48 46.82 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.428 1.491 . . . . 0.0 111.812 -175.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -132.83 133.83 43.87 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.557 1.943 . . . . 0.0 109.268 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -131.4 113.54 1.38 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 125.036 1.303 . . . . 0.0 112.089 -175.447 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.5 p -104.99 108.96 20.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.289 1.035 . . . . 0.0 112.122 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.65 143.49 15.05 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.927 1.727 . . . . 0.0 114.466 -173.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -17.85 1.47 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 177.199 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -161.5 179.51 8.17 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.499 1.92 . . . . 0.0 110.308 153.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -45.45 -40.45 8.3 Favored 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.357 1.863 . . . . 0.0 115.766 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.01 -16.96 5.62 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 174.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -118.33 -44.24 2.68 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.886 2.074 . . . . 0.0 111.378 176.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.46 -53.26 58.53 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.582 -1.324 . . . . 0.0 112.77 175.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.573 ' HG2' HG13 ' A' ' 7' ' ' VAL . 8.2 ttmt -55.24 -46.25 76.04 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-O 116.53 -1.7 . . . . 0.0 110.967 166.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.05 75.06 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 121.972 2.169 . . . . 0.0 112.578 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -55.48 -60.25 3.69 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.522 1.929 . . . . 0.0 112.163 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.24 -50.66 68.89 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.428 1.091 . . . . 0.0 112.322 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.5 -59.64 3.57 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.239 1.816 . . . . 0.0 111.618 170.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -48.35 72.77 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 120.104 1.32 . . . . 0.0 110.691 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -55.36 -60.33 3.55 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 173.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.37 -61.55 2.26 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 126.493 1.917 . . . . 0.0 112.307 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.439 HD13 ' HB2' ' A' ' 10' ' ' LEU . 11.7 tp -53.29 -53.26 53.46 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.647 2.379 . . . . 0.0 111.922 -177.539 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.33 74.42 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.052 0.842 . . . . 0.0 112.802 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 95.6 m -55.28 -62.55 1.6 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.6 0.76 . . . . 0.0 112.984 175.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 m -55.58 -46.29 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.95 -47.45 77.58 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.83 -38.93 70.69 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.719 1.208 . . . . 0.0 114.248 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -39.19 89.88 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.993 1.317 . . . . 0.0 111.803 167.36 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.313 25.2 m-70 99.77 39.79 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 131.178 3.791 . . . . 0.0 113.297 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.7 mt . . . . . 0 N--CA 1.481 1.077 0 C-N-CA 126.93 2.092 . . . . 0.0 113.168 173.718 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo . . . . . 0 CA--C 1.541 0.838 0 N-CA-C 113.176 0.414 . . . . 0.0 113.176 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.2 m 47.73 30.94 1.98 Allowed 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 166.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 143.22 -25.35 2.2 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 124.95 1.262 . . . . 0.0 113.951 -177.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -134.78 120.83 19.88 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.057 1.343 . . . . 0.0 111.614 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -58.99 145.1 81.02 Favored Pre-proline 0 CA--C 1.553 1.077 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 156.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -59.12 -33.54 98.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.599 2.199 . . . . 0.0 115.12 -178.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.502 HG13 ' HG2' ' A' ' 55' ' ' LYS . 42.6 t -55.18 -44.77 76.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 CA-C-N 118.85 0.75 . . . . 0.0 110.548 168.372 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.32 -42.64 74.02 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.854 -1.154 . . . . 0.0 113.019 177.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.6 mt -60.22 -57.39 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.648 1.179 . . . . 0.0 110.684 173.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.315 0.0 OUTLIER -55.84 -38.9 70.68 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 115.645 1.721 . . . . 0.0 115.645 176.291 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -56.13 -52.86 62.83 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 124.848 1.259 . . . . 0.0 111.559 171.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.26 -65.62 0.55 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.705 1.602 . . . . 0.0 113.175 173.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.8 mt -55.57 -43.41 75.88 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.636 1.574 . . . . 0.0 115.234 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.263 7.7 ptm85 30.24 66.89 0.79 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 128.299 2.64 . . . . 0.0 115.246 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -61.02 20.17 0.04 OUTLIER 'Trans proline' 0 CA--C 1.552 1.392 1 C-N-CA 125.777 4.318 . . . . 0.0 118.348 -175.284 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.19 30.36 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.123 1.345 . . . . 0.0 113.698 -175.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 pp -88.7 159.67 17.71 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -176.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.46 138.42 43.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.212 1.805 . . . . 0.0 112.493 -179.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -104.67 135.13 46.64 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.431 1.11 . . . . 0.0 112.85 -171.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -105.28 135.32 46.86 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.018 2.527 . . . . 0.0 108.843 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -108.35 121.11 44.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.114 0.959 . . . . 0.0 110.958 175.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.6 155.97 43.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 129.453 3.101 . . . . 0.0 107.123 -175.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.7 t -114.93 161.19 18.62 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 120.451 -1.405 . . . . 0.0 110.857 160.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.301 19.7 mm-40 95.7 82.53 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.163 2.185 . . . . 0.0 115.72 164.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.7 t -128.74 53.07 1.88 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.809 1.644 . . . . 0.0 110.285 161.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -162.67 -158.89 9.94 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 125.087 1.327 . . . . 0.0 113.083 -170.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -73.38 170.01 15.96 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.148 -2.384 . . . . 0.0 114.012 4.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.2 t -144.48 -151.28 0.36 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.561 1.944 . . . . 0.0 108.926 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -52.59 -18.82 1.92 Allowed 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.735 1.614 . . . . 0.0 114.03 163.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -148.98 173.98 12.77 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.583 2.353 . . . . 0.0 110.733 173.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.4 tppt? -61.75 152.35 31.47 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.821 1.248 . . . . 0.0 111.066 164.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.6 m -117.24 125.14 50.66 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.215 1.406 . . . . 0.0 110.599 169.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -104.71 135.74 45.54 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 105.915 -1.884 . . . . 0.0 105.915 170.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.3 t -112.84 117.5 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 122.038 0.923 . . . . 0.0 109.208 -169.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 78.9 mmm -104.77 135.04 46.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 173.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.2 m -132.81 135.47 45.69 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 122.47 0.308 . . . . 0.0 111.055 -176.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.11 135.51 60.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.303 1.041 . . . . 0.0 112.191 -173.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.6 t -104.47 120.11 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 167.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 78.2 t -125.04 -45.44 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -157.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -148.27 29.98 0.86 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 122.669 1.223 . . . . 0.0 111.066 -162.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.94 -12.71 22.47 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 120.532 -1.355 . . . . 0.0 112.963 -162.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -109.96 161.78 15.16 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 126.688 1.995 . . . . 0.0 111.735 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -134.85 137.96 43.75 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.039 1.736 . . . . 0.0 111.389 -162.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -134.97 149.94 50.29 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.373 1.469 . . . . 0.0 111.088 -175.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -132.9 135.04 45.34 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.274 1.43 . . . . 0.0 110.399 -174.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.83 117.41 1.75 Allowed Glycine 0 CA--C 1.523 0.557 0 C-N-CA 125.238 1.399 . . . . 0.0 112.707 -167.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 p -106.64 104.73 14.49 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.736 1.214 . . . . 0.0 112.26 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 147.73 19.33 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.633 1.587 . . . . 0.0 114.795 -173.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -44.24 -39.32 4.37 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -155.2 177.42 11.36 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.777 1.631 . . . . 0.0 110.333 165.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -45.23 -41.39 8.37 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 127.422 2.289 . . . . 0.0 116.159 -174.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 -13.87 1.74 Allowed 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.5 tp -125.98 -42.71 1.87 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.439 2.295 . . . . 0.0 111.505 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.72 40.49 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.443 -1.411 . . . . 0.0 112.333 172.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.502 ' HG2' HG13 ' A' ' 7' ' ' VAL . 11.2 ttmt -55.41 -39.77 70.62 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 117.419 -1.277 . . . . 0.0 111.932 168.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.39 -54.83 38.82 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.576 1.535 . . . . 0.0 111.667 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -54.99 -52.79 62.02 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.638 1.975 . . . . 0.0 113.661 171.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -52.62 63.11 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.622 0.769 . . . . 0.0 112.126 177.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.18 -53.65 47.51 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 125.854 1.662 . . . . 0.0 112.202 171.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -52.49 -50.4 62.81 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.634 1.574 . . . . 0.0 111.876 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.8 t -55.3 -56.45 19.91 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 113.034 171.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -61.45 2.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.771 1.229 . . . . 0.0 112.718 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.44 ' HG ' ' CE2' ' A' ' 67' ' ' PHE . 0.4 OUTLIER -46.23 -57.78 4.25 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 128.566 2.746 . . . . 0.0 111.5 176.881 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.89 -49.88 70.14 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.528 0.604 . . . . 0.0 111.103 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 50.2 m -55.24 -73.97 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 173.261 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.288 18.3 m -55.72 -44.62 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -175.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.44 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 6.6 m-30 -60.06 -44.54 94.65 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.652 -1.28 . . . . 0.0 114.149 172.365 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.83 -37.6 68.9 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.384 1.447 . . . . 0.0 114.439 168.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.49 -40.06 89.96 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.851 1.26 . . . . 0.0 111.594 167.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.303 23.6 m-70 100.53 42.99 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 130.923 3.689 . . . . 0.0 112.784 176.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.7 tp . . . . . 0 C--O 1.249 1.056 0 C-N-CA 126.157 1.783 . . . . 0.0 111.374 172.788 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo . . . . . 0 CA--C 1.539 0.764 0 N-CA-C 113.63 0.589 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 t 55.52 -165.69 0.11 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.811 1.644 . . . . 0.0 113.545 -176.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -171.49 -166.32 30.07 Favored Glycine 0 CA--C 1.54 1.626 0 N-CA-C 117.214 1.646 . . . . 0.0 117.214 -172.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -143.83 3.27 1.24 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 116.84 2.163 . . . . 0.0 116.84 13.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -56.34 101.63 0.27 Allowed Pre-proline 0 N--CA 1.48 1.062 0 CA-C-N 120.424 1.465 . . . . 0.0 110.7 174.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -78.94 -45.4 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.441 0 CA-C-N 121.004 1.394 . . . . 0.0 114.942 -141.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.535 HG22 ' HB3' ' A' ' 55' ' ' LYS . 90.0 t -55.04 -52.9 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 173.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -55.45 -54.77 39.68 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 127.154 2.181 . . . . 0.0 115.558 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.276 1.7 pt -59.95 -50.38 80.34 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-O 118.115 -0.945 . . . . 0.0 113.085 172.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.307 0.0 OUTLIER -55.52 -46.24 77.05 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.462 1.483 . . . . 0.0 113.521 178.692 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -46.96 -63.07 1.13 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.247 2.219 . . . . 0.0 111.809 168.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -56.28 -47.02 79.45 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 176.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.5 mt -55.67 -29.16 58.86 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.909 1.283 . . . . 0.0 114.342 171.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 35.36 60.41 2.62 Favored Pre-proline 0 N--CA 1.486 1.362 0 C-N-CA 126.782 2.033 . . . . 0.0 116.238 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -59.42 21.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.56 1.786 0 C-N-CA 125.244 3.963 . . . . 0.0 119.58 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.23 24.72 76.69 Favored Glycine 0 CA--C 1.536 1.391 0 O-C-N 119.856 -1.777 . . . . 0.0 112.775 -167.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.42 171.96 7.89 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.918 2.087 . . . . 0.0 115.032 -172.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.35 135.25 40.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.091 1.357 . . . . 0.0 111.942 158.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -104.68 135.63 45.71 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.235 1.414 . . . . 0.0 110.549 173.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -130.31 135.16 47.78 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.418 1.487 . . . . 0.0 109.906 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -107.98 128.56 54.76 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.578 1.18 . . . . 0.0 112.214 -168.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.8 151.49 52.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 129.839 3.256 . . . . 0.0 106.702 -172.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p -133.07 104.19 6.4 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 119.933 -1.73 . . . . 0.0 110.127 161.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -159.51 -12.07 0.06 Allowed 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 120.098 3.37 . . . . 0.0 120.098 -171.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.1 t -76.13 29.61 0.12 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 121.183 1.811 . . . . 0.0 113.813 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -171.22 13.64 0.05 OUTLIER Glycine 0 N--CA 1.469 0.845 0 C-N-CA 124.872 1.225 . . . . 0.0 115.253 -174.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -51.32 -40.27 58.69 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.905 1.446 . . . . 0.0 114.905 -157.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.7 m -81.86 -9.53 59.58 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -175.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -152.25 -26.59 0.17 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 117.293 2.331 . . . . 0.0 117.293 -165.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -144.05 -9.58 0.68 Allowed 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 -172.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.7 tptt 38.59 84.87 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.47 2.308 . . . . 0.0 113.327 -176.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.7 m -104.34 135.74 45.23 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.167 0.987 . . . . 0.0 109.526 -166.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -96.41 122.11 38.95 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 -164.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.4 t -109.89 124.24 66.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.021 -1.445 . . . . 0.0 109.89 -169.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 63.1 mmm -104.86 124.36 49.31 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -111.38 134.02 53.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.513 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.64 135.58 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.469 0.708 . . . . 0.0 111.571 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -104.47 119.79 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 166.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.7 m -133.65 -3.03 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 -160.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -155.43 -20.11 0.11 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 -174.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.31 -18.33 28.06 Favored Glycine 0 CA--C 1.538 1.48 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -142.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -105.0 162.17 13.58 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.701 1.6 . . . . 0.0 110.841 170.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -133.68 140.05 46.81 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.254 1.822 . . . . 0.0 110.925 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.03 159.56 41.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.103 1.361 . . . . 0.0 111.532 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -135.6 134.66 39.54 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.361 1.864 . . . . 0.0 109.411 176.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.1 120.71 2.83 Favored Glycine 0 CA--C 1.523 0.551 0 C-N-CA 125.158 1.361 . . . . 0.0 111.338 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.4 p -105.01 110.47 22.88 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.648 1.179 . . . . 0.0 111.708 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.47 155.75 22.35 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.867 1.698 . . . . 0.0 114.465 -168.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -55.06 -38.74 68.41 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.801 -0.823 . . . . 0.0 113.148 174.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -151.17 -177.44 6.04 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.794 1.638 . . . . 0.0 109.193 159.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.5 mtmm -44.22 -35.04 2.08 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 127.683 2.393 . . . . 0.0 115.082 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.2 pttt -46.34 -29.91 1.87 Allowed 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.5 tp -121.3 -40.7 2.56 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.193 2.197 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.55 -52.03 65.08 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.904 1.282 . . . . 0.0 112.664 173.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.535 ' HB3' HG22 ' A' ' 7' ' ' VAL . 5.4 ttmt -55.38 -47.93 75.07 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 117.398 -1.286 . . . . 0.0 110.866 166.172 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.8 73.7 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 120.471 1.487 . . . . 0.0 112.686 -176.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.4 mmm-85 -55.03 -59.77 4.3 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.885 2.874 . . . . 0.0 113.305 169.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -49.42 72.57 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.594 0.712 . . . . 0.0 112.506 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.98 -51.49 66.04 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 126.646 1.978 . . . . 0.0 112.111 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -54.94 -47.6 74.25 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.409 1.484 . . . . 0.0 111.904 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.33 -54.97 36.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.577 1.151 . . . . 0.0 112.774 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.1 -57.94 9.71 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.98 -55.06 13.05 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 128.371 2.668 . . . . 0.0 111.61 176.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.11 68.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.504 0.593 . . . . 0.0 110.92 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 27.1 m -55.47 -74.67 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 172.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.1 m -55.56 -37.28 45.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.26 4.8 m-30 -68.47 -33.61 74.48 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 171.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -55.51 -35.26 65.41 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.152 -1.592 . . . . 0.0 113.156 159.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.5 mt -65.44 -47.34 76.53 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 118.248 -0.882 . . . . 0.0 112.429 169.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -158.09 138.38 12.58 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 151.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.6 tt . . . . . 0 C--O 1.251 1.155 0 C-N-CA 128.674 2.789 . . . . 0.0 114.712 -168.539 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo . . . . . 0 N--CA 1.486 1.055 0 N-CA-C 113.863 0.678 . . . . 0.0 113.863 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.4 m -54.5 161.87 1.31 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.551 1.941 . . . . 0.0 114.297 176.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 111.55 21.29 6.55 Favored Glycine 0 CA--C 1.538 1.481 0 N-CA-C 115.453 0.941 . . . . 0.0 115.453 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 mtmm -137.85 -173.41 3.5 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.323 1.849 . . . . 0.0 110.418 -178.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -46.5 133.4 7.88 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.399 1.08 . . . . 0.0 111.417 172.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.14 -35.69 8.37 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 121.047 1.165 . . . . 0.0 113.786 -168.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.602 HG13 ' HG2' ' A' ' 55' ' ' LYS . 97.0 t -54.99 -53.24 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 171.067 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.55 -55.47 31.59 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.271 7.3 pt -58.42 -47.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 120.735 1.607 . . . . 0.0 114.399 174.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 7' ' ' VAL 0.275 0.0 OUTLIER -55.58 -46.65 77.22 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 174.676 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -55.2 -54.69 40.16 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.464 1.905 . . . . 0.0 112.324 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -55.4 -61.1 2.56 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.548 1.939 . . . . 0.0 113.259 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.432 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 8.3 mt -55.62 -34.91 65.32 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 175.837 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 36.76 58.57 3.64 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 127.127 2.171 . . . . 0.0 114.598 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.62 65.61 1.2 Allowed 'Trans proline' 0 CA--C 1.551 1.366 0 C-N-CA 124.52 3.48 . . . . 0.0 115.253 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.58 29.48 75.26 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.787 1.661 . . . . 0.0 114.835 172.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.3 pp -105.21 166.27 10.52 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 -163.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.31 145.63 47.67 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.733 2.013 . . . . 0.0 111.886 166.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -104.56 128.92 52.66 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.686 0.795 . . . . 0.0 110.471 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -104.89 134.34 48.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.227 1.811 . . . . 0.0 109.258 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.445 ' CE1' ' HE3' ' A' ' 51' ' ' LYS . 62.9 t80 -113.17 126.11 55.08 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.784 1.278 . . . . 0.0 110.969 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.93 154.92 47.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 130.065 3.346 . . . . 0.0 106.024 -173.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.5 t -133.94 116.5 15.65 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 119.577 -1.952 . . . . 0.0 110.133 164.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.62 -50.86 0.09 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -143.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -79.82 179.86 7.32 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.921 1.688 . . . . 0.0 112.382 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.07 -32.15 4.27 Favored Glycine 0 N--CA 1.476 1.328 0 N-CA-C 117.964 1.946 . . . . 0.0 117.964 148.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.23 -3.71 0.29 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.512 1.925 . . . . 0.0 115.959 -169.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.0 p -41.72 -31.6 0.31 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.101 1.36 . . . . 0.0 114.565 151.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -150.67 -47.06 0.12 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.948 1.699 . . . . 0.0 112.418 176.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -167.34 154.1 8.35 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.409 1.884 . . . . 0.0 110.589 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -46.32 133.53 9.53 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.627 1.171 . . . . 0.0 113.114 -176.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.3 m -123.04 139.48 54.04 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 127.054 2.141 . . . . 0.0 111.64 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -99.07 134.28 42.13 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 -170.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.4 t -112.99 127.21 70.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 123.287 1.518 . . . . 0.0 110.22 -170.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.75 135.12 46.72 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.961 -1.472 . . . . 0.0 107.571 171.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -122.67 135.31 54.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 122.739 0.416 . . . . 0.0 110.582 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.88 135.78 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.555 -0.716 . . . . 0.0 111.529 172.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.8 t -101.09 122.07 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 160.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.97 142.75 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 127.015 2.126 . . . . 0.0 108.881 -167.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.8 t70 58.32 -67.04 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.428 1.891 . . . . 0.0 114.172 -174.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -170.11 17.97 0.07 OUTLIER Glycine 0 CA--C 1.541 1.706 0 C-N-CA 128.539 2.971 . . . . 0.0 112.827 169.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -134.96 165.81 24.48 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.767 2.427 . . . . 0.0 111.73 -168.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -134.86 128.61 32.98 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.467 1.107 . . . . 0.0 112.222 -162.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.37 136.59 43.48 Favored 'General case' 0 C--O 1.206 -1.218 0 C-N-CA 124.923 1.289 . . . . 0.0 111.956 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -104.44 134.51 47.52 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 126.719 2.008 . . . . 0.0 109.85 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.69 112.67 1.16 Allowed Glycine 0 CA--C 1.52 0.367 0 C-N-CA 124.796 1.189 . . . . 0.0 112.202 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 p -104.8 117.18 33.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.671 0.788 . . . . 0.0 111.867 -172.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.52 146.49 18.5 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 125.158 1.361 . . . . 0.0 115.489 -166.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.42 -36.04 6.13 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 168.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -157.52 178.18 10.58 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.792 2.037 . . . . 0.0 109.066 162.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.445 ' HE3' ' CE1' ' A' ' 21' ' ' PHE . 82.0 mttt -46.44 -36.4 6.54 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 126.676 1.99 . . . . 0.0 115.162 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -16.14 2.42 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.249 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.3 tp -123.31 -43.29 2.2 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.7 2.0 . . . . 0.0 110.724 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.5 -52.43 63.7 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.554 -1.341 . . . . 0.0 112.279 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.602 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.4 ttmt -55.41 -47.28 76.16 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 117.529 -1.224 . . . . 0.0 110.677 169.026 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.49 -47.68 75.8 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 120.273 1.397 . . . . 0.0 112.615 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -55.48 -59.66 4.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.738 2.015 . . . . 0.0 112.03 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.35 -49.84 71.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.39 1.076 . . . . 0.0 112.092 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.23 -58.62 6.43 Favored 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 126.344 1.858 . . . . 0.0 112.406 173.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -55.31 -44.86 76.17 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.442 1.474 . . . . 0.0 111.689 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.6 m -55.26 -55.31 32.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.87 0.868 . . . . 0.0 112.505 173.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.24 -56.24 22.26 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.739 1.215 . . . . 0.0 112.329 174.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.41 -56.87 6.08 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 128.047 2.539 . . . . 0.0 111.183 176.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.15 -52.69 60.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.298 0.499 . . . . 0.0 110.762 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -71.2 0.09 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 175.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.289 24.7 m -55.26 -51.32 56.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 O-C-N 121.058 -1.026 . . . . 0.0 112.587 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.432 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 5.9 m-30 -55.79 -33.93 64.84 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 121.366 1.894 . . . . 0.0 114.777 174.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -55.72 -38.12 69.32 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 162.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.9 mt -57.23 -48.95 77.54 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 162.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -165.11 175.13 9.64 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 -153.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.8 mt . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.916 1.686 . . . . 0.0 111.323 159.237 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 N--CA 1.489 1.222 0 N-CA-C 111.976 -0.048 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.1 t -154.98 142.76 19.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.672 1.189 . . . . 0.0 111.48 176.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 166.56 -60.17 0.23 Allowed Glycine 0 CA--C 1.528 0.896 0 O-C-N 119.269 -2.144 . . . . 0.0 114.075 -7.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.9 tmtt? -57.74 -44.87 86.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.141 0.976 . . . . 0.0 113.003 178.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -56.03 -49.69 91.61 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 116.885 -1.531 . . . . 0.0 114.973 -171.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.7 -39.71 25.57 Favored 'Trans proline' 0 C--N 1.35 0.612 0 CA-C-N 122.383 1.887 . . . . 0.0 113.825 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.7 t -54.24 -50.93 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -55.71 28.44 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.09 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.0 pt -55.58 -49.2 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.821 1.191 . . . . 0.0 113.671 172.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.445 ' HA ' HD13 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -54.56 -51.26 65.81 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.51 1.05 . . . . 0.0 112.047 177.131 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -55.63 -54.01 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.207 1.803 . . . . 0.0 112.72 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -59.99 -45.03 94.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -39.56 71.33 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.963 1.305 . . . . 0.0 113.359 171.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 30.85 61.11 1.05 Allowed Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 127.826 2.45 . . . . 0.0 116.241 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -53.63 -38.83 84.49 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.513 2.142 . . . . 0.0 114.918 -174.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.36 33.92 0.12 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.411 1.481 . . . . 0.0 112.258 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.446 HD13 ' CE1' ' A' ' 19' ' ' TYR . 1.4 pp -77.61 151.58 34.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 117.046 2.239 . . . . 0.0 117.046 -154.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 135.8 40.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.203 2.201 . . . . 0.0 112.606 157.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.635 ' CD2' ' HE3' ' A' ' 55' ' ' LYS . 65.3 m-85 -104.86 135.58 45.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.822 1.249 . . . . 0.0 112.913 -177.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -108.12 135.73 48.98 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 128.664 2.785 . . . . 0.0 110.91 173.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -104.97 126.57 52.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.558 1.143 . . . . 0.0 111.452 171.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.7 mp -135.05 144.28 47.18 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 129.475 3.11 . . . . 0.0 106.903 -173.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p -74.54 176.12 7.16 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 119.31 -2.119 . . . . 0.0 111.293 149.142 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.308 8.2 tp10 134.51 -5.49 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 119.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 t -61.11 153.67 25.07 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.081 -1.012 . . . . 0.0 110.879 164.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -153.12 163.01 30.41 Favored Glycine 0 CA--C 1.532 1.123 0 O-C-N 121.431 -0.793 . . . . 0.0 112.959 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -136.09 44.02 2.48 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.772 1.229 . . . . 0.0 111.102 -152.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.3 p 64.34 -31.76 0.12 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 129.254 3.022 . . . . 0.0 116.731 -175.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -148.25 12.98 0.96 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.512 1.525 . . . . 0.0 112.97 178.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -146.91 171.5 15.13 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.303 1.441 . . . . 0.0 111.252 176.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -130.31 147.71 52.05 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.109 1.363 . . . . 0.0 112.541 -175.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.56 146.8 50.4 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 128.05 2.54 . . . . 0.0 111.568 -171.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -104.14 135.01 46.43 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 104.146 -2.539 . . . . 0.0 104.146 -179.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.7 t -112.98 116.55 52.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 123.103 1.43 . . . . 0.0 109.063 -161.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.8 mmt -105.14 122.94 46.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.478 -1.237 . . . . 0.0 107.859 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -128.5 135.24 49.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -172.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.2 t -135.03 135.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 120.839 -1.163 . . . . 0.0 109.724 -163.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.7 t -104.1 104.73 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 103.061 -2.941 . . . . 0.0 103.061 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.8 p -100.84 -12.39 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -152.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -167.72 -37.38 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.258 2.223 . . . . 0.0 111.643 -158.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 150.78 -25.06 1.04 Allowed Glycine 0 CA--C 1.538 1.515 0 C-N-CA 125.872 1.701 . . . . 0.0 110.72 -161.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.85 163.0 13.07 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 125.26 1.424 . . . . 0.0 110.372 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.81 138.67 53.85 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.71 1.604 . . . . 0.0 112.079 -168.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -135.11 157.67 46.34 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.166 1.786 . . . . 0.0 111.844 -172.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -139.54 133.48 30.86 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.442 1.497 . . . . 0.0 110.384 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.96 119.58 2.17 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.471 1.51 . . . . 0.0 112.305 -173.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.2 p -105.24 104.96 14.79 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.409 1.084 . . . . 0.0 112.413 -171.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.87 138.03 9.6 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 125.115 1.34 . . . . 0.0 115.766 -176.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -57.66 -12.92 3.24 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -155.5 177.85 10.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.527 1.131 . . . . 0.0 111.231 155.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -49.75 -51.76 36.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 124.834 1.253 . . . . 0.0 113.818 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -6.76 0.44 Allowed 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 177.299 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.3 tp -115.26 -44.74 2.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.712 1.605 . . . . 0.0 110.308 171.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.56 -59.2 5.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.876 1.271 . . . . 0.0 113.086 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.635 ' HE3' ' CD2' ' A' ' 19' ' ' TYR . 18.8 mmtm -55.45 -37.81 68.21 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 115.288 -2.291 . . . . 0.0 112.581 164.771 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.72 -54.67 41.43 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 123.355 2.798 . . . . 0.0 111.492 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.33 -55.43 31.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 129.089 2.956 . . . . 0.0 113.749 170.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.41 -56.62 17.99 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 111.462 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.42 ' CB ' ' HG ' ' A' ' 10' ' ' LEU . . . -44.97 -62.04 1.39 Allowed 'General case' 0 C--O 1.215 -0.749 0 C-N-CA 124.084 0.953 . . . . 0.0 113.161 166.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -47.53 -53.19 15.07 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.413 1.485 . . . . 0.0 112.015 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 25.1 p -55.4 -57.57 11.33 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 173.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.32 -64.25 0.9 Allowed 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 126.635 1.974 . . . . 0.0 112.014 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.445 HD13 ' HA ' ' A' ' 10' ' ' LEU . 11.9 tp -50.43 -54.45 21.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.677 2.791 . . . . 0.0 111.988 -179.101 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.17 -49.39 71.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.504 0.593 . . . . 0.0 112.388 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.3 m -55.43 -60.99 2.64 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 175.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 4.8 m -55.26 -47.56 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.275 0.943 . . . . 0.0 112.707 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.85 -47.05 77.97 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -55.49 -39.72 70.79 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.732 1.213 . . . . 0.0 112.541 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -63.15 1.34 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.813 1.245 . . . . 0.0 110.374 166.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -170.79 164.51 7.94 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.163 1.785 . . . . 0.0 113.466 155.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.146 0 C-N-CA 126.958 2.103 . . . . 0.0 109.842 170.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo . . . . . 0 C--O 1.235 0.341 0 N-CA-C 114.862 1.062 . . . . 0.0 114.862 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.559 HG13 ' HG2' ' A' ' 55' ' ' LYS . 71.8 t -55.09 -51.53 53.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.33 -44.26 75.69 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.072 1.349 . . . . 0.0 114.386 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mt -58.23 -57.76 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 123.829 0.851 . . . . 0.0 112.148 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -55.32 -38.54 68.84 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.601 0.715 . . . . 0.0 112.304 178.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -55.08 -61.31 2.4 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.152 1.781 . . . . 0.0 111.928 168.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -55.57 -56.47 19.99 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.05 -1.031 . . . . 0.0 113.179 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.6 mt -55.93 -29.16 59.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 117.504 2.409 . . . . 0.0 117.504 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.325 0.0 OUTLIER -9.21 75.92 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.757 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 -167.695 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -58.04 -34.55 98.55 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 122.022 1.815 . . . . 0.0 116.196 -165.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 177.55 30.12 0.04 OUTLIER Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.228 1.394 . . . . 0.0 112.123 172.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -96.51 164.14 12.74 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -161.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.12 141.28 45.96 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.634 1.574 . . . . 0.0 112.535 173.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -104.55 135.23 46.34 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.623 1.169 . . . . 0.0 111.764 -177.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -104.82 135.25 46.53 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.106 1.362 . . . . 0.0 109.685 164.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -104.43 119.94 40.1 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.103 0.954 . . . . 0.0 109.016 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 136.02 54.57 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 128.846 2.859 . . . . 0.0 106.57 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 C--N 1.318 -0.766 0 O-C-N 119.463 -2.023 . . . . 0.0 109.756 154.723 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 . . . . . 0 N--CA 1.445 -0.707 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.92 130.09 71.19 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 122.711 1.243 . . . . 0.0 109.875 -167.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 5.4 mmt -115.09 123.87 50.11 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.532 0.733 . . . . 0.0 110.333 177.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.88 136.58 44.11 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.931 0.892 . . . . 0.0 110.443 172.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.4 m -121.98 135.87 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.114 0.566 . . . . 0.0 112.397 167.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.9 t -104.47 128.54 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 161.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.436 HG13 ' H ' ' A' ' 40' ' ' ASP 0.305 7.7 p -126.74 -110.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 124.626 1.17 . . . . 0.0 111.508 -179.373 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.436 ' H ' HG13 ' A' ' 39' ' ' VAL . 25.4 t0 -81.14 45.22 0.82 Allowed 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 121.189 1.813 . . . . 0.0 114.025 -168.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.4 13.99 80.89 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.935 -1.103 . . . . 0.0 112.07 -166.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -119.09 153.1 35.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 127.013 2.125 . . . . 0.0 109.981 -171.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -134.01 134.63 42.67 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.489 1.116 . . . . 0.0 111.712 -174.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -135.24 154.65 51.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.062 1.345 . . . . 0.0 111.287 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -134.74 134.81 41.4 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.133 2.173 . . . . 0.0 108.573 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.04 122.19 2.78 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 124.828 1.204 . . . . 0.0 111.901 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.6 p -105.68 114.55 28.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.554 1.142 . . . . 0.0 111.511 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.57 145.28 17.3 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.686 1.136 . . . . 0.0 115.818 -175.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.47 -24.13 0.47 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 172.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -158.25 177.67 11.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.91 1.684 . . . . 0.0 109.699 156.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.406 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 28.4 mtmm -49.28 -36.2 19.99 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 126.545 1.938 . . . . 0.0 115.149 177.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -13.08 1.26 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 170.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.6 tp -125.53 -42.71 1.93 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.884 2.074 . . . . 0.0 110.862 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.406 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.45 -54.62 41.53 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.584 -1.322 . . . . 0.0 111.61 173.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.559 ' HG2' HG13 ' A' ' 7' ' ' VAL . 9.4 ttmt -55.48 -42.5 74.45 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.071 -1.442 . . . . 0.0 111.676 167.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.34 -51.42 66.81 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 121.238 1.836 . . . . 0.0 112.838 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -55.25 -56.33 21.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 129.495 3.118 . . . . 0.0 112.493 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.22 -53.54 54.79 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.836 1.254 . . . . 0.0 112.577 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.48 -56.46 9.69 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 126.409 1.884 . . . . 0.0 112.037 170.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -53.81 -48.0 70.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.697 1.599 . . . . 0.0 112.452 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.1 m -55.29 -57.92 9.84 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.581 1.152 . . . . 0.0 112.743 172.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -58.22 8.58 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.63 1.172 . . . . 0.0 111.762 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.417 ' HG ' ' CE2' ' A' ' 67' ' ' PHE . 0.5 OUTLIER -40.23 -59.43 1.28 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.416 2.687 . . . . 0.0 110.86 173.529 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.81 -56.66 15.52 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.174 0.443 . . . . 0.0 111.489 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 93.0 m -55.25 -70.35 0.11 Allowed 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 176.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.259 12.0 m -55.46 -40.85 60.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.417 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 6.8 m-30 -60.46 -40.24 90.47 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.166 -1.584 . . . . 0.0 114.212 170.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -35.14 65.23 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.262 1.392 . . . . 0.0 114.456 162.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt . . . . . 0 N--CA 1.481 1.094 0 CA-C-N 118.829 0.741 . . . . 0.0 112.999 169.548 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo . . . . . 0 C--O 1.234 0.307 0 N-CA-C 113.933 0.705 . . . . 0.0 113.933 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.501 HG13 ' HG2' ' A' ' 55' ' ' LYS . 86.4 t -55.18 -49.34 72.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 173.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -46.85 75.98 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.0 mt -55.85 -56.17 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 119.611 1.096 . . . . 0.0 111.212 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.507 HD21 ' HE2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -54.83 -43.73 73.26 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.127 0.971 . . . . 0.0 112.719 -179.672 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -56.22 -58.02 9.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 127.006 2.122 . . . . 0.0 112.501 172.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -55.21 -55.02 36.04 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.81 2.044 . . . . 0.0 112.359 177.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mt -55.97 -38.15 70.01 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 171.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.288 0.0 OUTLIER 24.11 65.39 0.4 Allowed Pre-proline 0 N--CA 1.488 1.459 0 C-N-CA 127.399 2.28 . . . . 0.0 115.156 -168.724 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.53 55.93 3.83 Favored 'Trans proline' 0 CA--C 1.549 1.249 0 C-N-CA 124.811 3.674 . . . . 0.0 113.566 -173.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 63.19 24.27 67.05 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 125.8 1.666 . . . . 0.0 115.431 173.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.486 HD21 ' CD2' ' A' ' 10' ' ' LEU . 3.1 pp -90.62 173.3 8.12 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.494 1.147 . . . . 0.0 112.998 -172.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -133.26 134.93 44.58 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.823 0.849 . . . . 0.0 111.19 169.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.507 ' HE2' HD21 ' A' ' 10' ' ' LEU . 10.5 m-85 -104.49 135.3 46.17 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.59 1.556 . . . . 0.0 109.888 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -123.3 135.53 54.26 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 126.822 2.049 . . . . 0.0 109.793 179.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -104.72 130.42 52.79 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 122.754 1.264 . . . . 0.0 111.906 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.08 157.35 47.16 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 129.617 3.167 . . . . 0.0 108.386 -171.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.4 p . . . . . 0 C--N 1.319 -0.73 0 C-N-CA 125.489 1.516 . . . . 0.0 111.656 172.842 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 . . . . . 0 N--CA 1.45 -0.456 0 N-CA-C 104.038 -2.578 . . . . 0.0 104.038 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.6 t -115.17 130.32 69.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 122.153 0.978 . . . . 0.0 108.976 -168.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 52.7 mmm -117.03 119.45 35.32 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.513 0.725 . . . . 0.0 109.797 177.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.97 138.37 41.29 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.883 1.273 . . . . 0.0 110.207 177.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.466 HG13 ' CG ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -133.14 136.0 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.28 -0.887 . . . . 0.0 111.866 -177.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.35 127.07 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 161.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.3 141.93 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.897 1.679 . . . . 0.0 108.787 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.7 t70 56.65 -79.92 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 126.225 1.81 . . . . 0.0 113.698 -173.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -161.75 24.99 0.24 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 129.049 3.214 . . . . 0.0 110.418 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -124.35 156.68 36.62 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.182 2.593 . . . . 0.0 109.05 -169.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -134.61 136.93 43.27 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.952 0.901 . . . . 0.0 111.4 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -135.1 159.54 41.2 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.17 0.988 . . . . 0.0 111.736 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -131.12 129.21 41.55 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.727 2.011 . . . . 0.0 108.388 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.77 117.86 3.02 Favored Glycine 0 C--O 1.227 -0.301 0 C-N-CA 124.828 1.204 . . . . 0.0 110.293 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 p -104.72 116.32 31.83 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.475 1.11 . . . . 0.0 109.421 -173.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.404 ' HA3' ' N ' ' A' ' 54' ' ' ALA . . . -142.32 135.89 6.9 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 120.941 -1.1 . . . . 0.0 115.592 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.9 ttt85 -40.6 -22.9 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 170.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -153.53 -177.98 6.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.483 1.113 . . . . 0.0 111.16 147.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.439 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 35.4 mtmt -49.24 -37.5 23.54 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 126.644 1.978 . . . . 0.0 114.797 177.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -13.91 1.69 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 171.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.6 tp -121.58 -44.48 2.34 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.99 2.116 . . . . 0.0 110.26 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.66 -57.19 13.01 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 125.666 1.586 . . . . 0.0 112.4 175.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.501 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.5 ttmt -55.23 -44.28 75.32 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 116.507 -1.711 . . . . 0.0 110.936 168.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.57 -50.93 68.78 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 121.924 2.147 . . . . 0.0 112.741 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.6 mmm-85 -54.54 -58.6 6.86 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.146 2.178 . . . . 0.0 111.555 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.66 -54.16 47.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.941 0.897 . . . . 0.0 112.872 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.92 -55.85 15.19 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 126.88 2.072 . . . . 0.0 112.863 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -47.88 74.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 121.019 1.736 . . . . 0.0 111.406 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.0 m -55.05 -53.61 53.62 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.215 0.606 . . . . 0.0 112.049 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.06 -59.59 4.55 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.398 1.479 . . . . 0.0 111.734 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.43 -63.46 0.82 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 128.37 2.668 . . . . 0.0 110.627 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.95 -49.92 70.19 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.018 0.527 . . . . 0.0 111.082 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 46.4 m -55.24 -71.35 0.09 Allowed 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.276 11.4 m -55.59 -44.22 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.721 1.208 . . . . 0.0 114.062 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -55.97 -47.97 76.69 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 170.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -36.43 69.01 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.249 1.386 . . . . 0.0 113.903 168.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 124.405 1.082 . . . . 0.0 111.273 172.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo . . . . . 0 N--CA 1.461 -0.423 0 N-CA-C 113.607 0.58 . . . . 0.0 113.607 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.446 HG22 ' HB3' ' A' ' 55' ' ' LYS . 59.9 t -54.46 -52.95 34.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -55.91 -53.02 61.93 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 116.051 1.871 . . . . 0.0 116.051 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.1 pt -57.66 -48.21 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.27 0.941 . . . . 0.0 113.507 171.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -55.71 -41.51 73.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 174.455 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.13 -56.67 17.28 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.527 1.931 . . . . 0.0 111.804 171.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.274 1.8 pt-20 -57.39 -59.78 4.63 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 175.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -55.8 -33.71 64.66 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 176.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.277 0.0 OUTLIER 15.04 67.87 0.16 Allowed Pre-proline 0 N--CA 1.487 1.415 0 C-N-CA 129.523 3.129 . . . . 0.0 118.092 -175.633 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.17 43.14 0.09 OUTLIER 'Trans proline' 0 CA--C 1.558 1.683 1 C-N-CA 125.921 4.414 . . . . 0.0 118.848 -175.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.45 32.85 24.05 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 120.065 -1.647 . . . . 0.0 113.771 177.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -103.8 166.63 10.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -166.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -134.79 138.77 44.57 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.922 2.089 . . . . 0.0 111.692 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -104.54 135.26 46.29 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.715 1.206 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -118.51 135.27 54.49 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 127.619 2.368 . . . . 0.0 109.261 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -108.66 124.78 51.05 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 122.331 1.062 . . . . 0.0 111.874 -174.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.417 ' HB2' HG13 ' A' ' 34' ' ' VAL . 3.8 mp -131.9 167.51 19.49 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 129.895 3.278 . . . . 0.0 106.309 -173.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.9 p . . . . . 0 C--N 1.321 -0.638 0 O-C-N 119.937 -1.727 . . . . 0.0 113.168 159.93 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 . . . . . 0 N--CA 1.457 -0.098 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.417 HG13 ' HB2' ' A' ' 22' ' ' LEU 0.327 0.1 OUTLIER -107.53 135.02 47.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 122.745 1.26 . . . . 0.0 112.561 175.759 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 76.1 mmm -125.16 117.33 23.64 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.406 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.3 m -115.83 135.19 54.24 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.386 0.674 . . . . 0.0 109.709 -172.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -121.33 135.81 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.446 1.098 . . . . 0.0 112.067 -174.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.3 t -104.41 125.98 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 165.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.3 p -146.71 145.37 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 126.878 2.071 . . . . 0.0 109.095 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.5 t70 62.16 -23.66 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 130.62 3.78 4.52 Favored Glycine 0 CA--C 1.544 1.87 0 C-N-CA 126.569 2.033 . . . . 0.0 113.585 -167.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -135.02 165.7 24.74 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.192 2.197 . . . . 0.0 111.832 -173.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.23 137.22 44.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.365 1.066 . . . . 0.0 112.689 -163.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -135.03 150.72 50.35 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.131 1.773 . . . . 0.0 110.809 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.53 110.55 10.56 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.288 1.035 . . . . 0.0 110.557 -174.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.97 109.1 3.21 Favored Glycine 0 CA--C 1.527 0.792 0 C-N-CA 126.018 1.771 . . . . 0.0 112.018 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.0 m -108.02 104.94 14.49 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.052 0.926 . . . . 0.0 112.601 -172.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.45 136.46 7.89 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.832 1.682 . . . . 0.0 114.791 -172.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -13.63 -59.1 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 127.057 2.143 . . . . 0.0 116.739 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -136.94 177.2 8.05 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.067 1.747 . . . . 0.0 109.908 169.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -46.88 -46.01 20.82 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 120.015 1.28 . . . . 0.0 114.093 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.63 -23.43 1.7 Allowed 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 174.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -108.39 -40.19 5.21 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.235 1.414 . . . . 0.0 111.31 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.39 -56.83 15.63 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.694 1.197 . . . . 0.0 112.575 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.446 ' HB3' HG22 ' A' ' 7' ' ' VAL . 11.0 mmtt -55.41 -35.63 65.56 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 115.698 -2.096 . . . . 0.0 113.249 165.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.55 -54.81 39.36 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 122.501 2.41 . . . . 0.0 110.94 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -55.0 -53.26 58.04 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.305 2.242 . . . . 0.0 114.05 169.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.51 -56.67 17.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.225 1.01 . . . . 0.0 111.952 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.33 -60.07 2.55 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.291 1.036 . . . . 0.0 113.207 166.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -50.51 -48.43 57.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.336 1.454 . . . . 0.0 112.92 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.12 -59.16 5.15 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 112.486 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.17 -57.1 13.13 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.869 -1.062 . . . . 0.0 111.998 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -42.15 -64.32 0.61 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.288 2.635 . . . . 0.0 111.121 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.82 66.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.129 0.422 . . . . 0.0 111.092 -178.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 41.0 m -55.44 -73.17 0.06 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 175.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.253 11.6 m -55.52 -42.02 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.73 1.212 . . . . 0.0 113.845 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -56.63 -47.02 80.59 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.638 1.108 . . . . 0.0 113.4 169.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -55.3 -33.8 63.58 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 169.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt . . . . . 0 N--CA 1.479 1.018 0 CA-C-N 119.242 0.928 . . . . 0.0 110.746 167.567 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 CA--C 1.53 0.301 0 N-CA-C 114.58 0.954 . . . . 0.0 114.58 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.426 HG22 ' HB3' ' A' ' 55' ' ' LYS . 42.3 t -54.99 -50.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 122.152 0.977 . . . . 0.0 109.067 172.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.54 -49.99 71.19 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.258 10.7 pt -58.8 -48.89 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-N 120.653 1.569 . . . . 0.0 114.563 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.283 0.0 OUTLIER -55.53 -39.95 71.21 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.022 -1.049 . . . . 0.0 113.434 176.045 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -58.57 7.12 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.614 1.966 . . . . 0.0 112.117 167.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.8 -54.93 38.46 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.408 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 11.5 mt -55.9 -42.19 75.64 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.139 1.375 . . . . 0.0 114.584 172.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 27.38 65.17 0.59 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 128.369 2.668 . . . . 0.0 116.202 -171.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.97 74.74 0.05 OUTLIER 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 124.953 3.769 . . . . 0.0 117.117 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.86 35.15 89.73 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.691 1.615 . . . . 0.0 114.936 173.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 pp -111.81 157.46 20.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -154.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.78 141.09 44.74 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 127.419 2.288 . . . . 0.0 114.175 167.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -104.48 135.36 46.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.451 1.101 . . . . 0.0 111.44 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.58 135.43 48.12 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.909 2.083 . . . . 0.0 110.064 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -104.58 129.69 52.65 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 123.312 1.53 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -134.76 145.33 48.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 130.369 3.468 . . . . 0.0 105.944 -168.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.6 t . . . . . 0 C--N 1.317 -0.845 0 O-C-N 118.921 -2.362 . . . . 0.0 108.264 -171.971 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 . . . . . 0 CA--C 1.509 -0.624 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 98.0 t -118.07 134.88 60.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 123.3 1.524 . . . . 0.0 109.45 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.06 124.29 46.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 171.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.3 t -120.22 134.35 55.28 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.676 0.671 . . . . 0.0 111.139 169.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -121.51 135.63 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.548 0.739 . . . . 0.0 110.322 -169.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -94.85 114.27 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.2 t -138.52 137.0 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.596 1.958 . . . . 0.0 108.337 -168.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 t70 59.02 -66.34 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.75 2.02 . . . . 0.0 114.044 -170.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 18.97 0.06 OUTLIER Glycine 0 CA--C 1.542 1.737 0 C-N-CA 128.031 2.729 . . . . 0.0 112.692 170.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -135.21 165.11 26.17 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.931 2.492 . . . . 0.0 110.944 -168.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -127.01 128.68 46.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.756 0.822 . . . . 0.0 112.508 -162.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -135.11 103.3 5.5 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.445 1.098 . . . . 0.0 113.533 -164.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -77.84 135.26 37.9 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 127.605 2.362 . . . . 0.0 110.432 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.98 123.67 3.19 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 125.948 1.737 . . . . 0.0 110.34 174.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.2 t -113.63 113.01 24.45 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.817 0.847 . . . . 0.0 111.175 -173.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.74 149.91 20.17 Favored Glycine 0 CA--C 1.529 0.939 0 C-N-CA 125.387 1.47 . . . . 0.0 115.767 -174.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -53.32 -23.01 8.17 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 175.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -157.7 -174.82 5.05 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.94 1.696 . . . . 0.0 110.288 152.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -45.19 -49.24 12.31 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.993 1.717 . . . . 0.0 114.27 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -14.15 1.13 Allowed 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.5 tp -114.66 -41.31 3.43 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.334 1.854 . . . . 0.0 111.294 172.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -55.29 33.47 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.371 174.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.426 ' HB3' HG22 ' A' ' 7' ' ' VAL . 13.5 mmtt -55.35 -41.93 73.2 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-O 115.413 -2.232 . . . . 0.0 113.593 162.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -50.19 70.59 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 123.444 2.838 . . . . 0.0 111.17 -178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -54.99 -58.16 8.77 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 129.222 3.009 . . . . 0.0 113.259 168.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -56.38 20.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.673 1.189 . . . . 0.0 112.168 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -44.86 -60.33 2.1 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.271 1.428 . . . . 0.0 114.454 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -55.01 -45.45 75.1 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.794 1.179 . . . . 0.0 112.716 -177.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.48 -56.84 15.56 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.32 1.048 . . . . 0.0 112.507 171.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -59.35 4.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.62 1.168 . . . . 0.0 112.24 177.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -57.62 5.82 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.871 2.068 . . . . 0.0 111.884 178.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.97 -49.07 72.33 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.133 0.424 . . . . 0.0 111.331 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -55.28 -68.06 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.3 m -55.47 -46.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -177.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.408 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 8.8 m-30 -55.94 -48.34 75.92 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -38.07 69.08 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.054 0.843 . . . . 0.0 112.556 170.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.549 0.929 0 C-N-CA 124.504 1.122 . . . . 0.0 110.181 168.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo . . . . . 0 C--O 1.236 0.414 0 N-CA-C 114.659 0.984 . . . . 0.0 114.659 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.531 HG13 ' HG2' ' A' ' 55' ' ' LYS . 95.5 t -54.78 -50.83 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -55.29 -44.45 75.74 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.993 1.317 . . . . 0.0 114.401 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.438 ' H ' HG13 ' A' ' 9' ' ' ILE . 8.5 mt -55.92 -59.51 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 125.254 1.422 . . . . 0.0 112.316 168.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.264 0.0 OUTLIER -55.54 -39.31 70.4 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.696 0.798 . . . . 0.0 112.447 -179.556 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.58 -57.71 10.8 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 127.538 2.335 . . . . 0.0 112.163 168.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -55.37 -58.05 9.34 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.601 1.56 . . . . 0.0 112.001 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 13.3 mt -55.82 -35.76 66.73 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.423 ' HA ' ' HD2' ' A' ' 15' ' ' PRO 0.366 0.0 OUTLIER -10.11 90.71 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.238 0 C-N-CA 127.835 2.454 . . . . 0.0 117.387 -161.883 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 14' ' ' ARG . 74.0 Cg_endo -66.98 -166.1 0.11 Allowed 'Trans proline' 0 CA--C 1.549 1.234 0 C-N-CA 122.457 2.105 . . . . 0.0 111.544 169.251 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.43 66.04 0.4 Allowed Glycine 0 CA--C 1.539 1.547 0 O-C-N 120.631 -1.293 . . . . 0.0 114.117 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 pp -112.0 167.14 10.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.848 1.659 . . . . 0.0 113.343 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -135.23 138.87 43.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.54 1.536 . . . . 0.0 112.443 167.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -104.25 135.24 46.09 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.353 1.073 . . . . 0.0 109.62 172.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -114.08 135.33 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 127.83 2.452 . . . . 0.0 108.568 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -107.04 119.65 39.96 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.351 1.072 . . . . 0.0 111.147 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.38 150.48 45.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 129.827 3.251 . . . . 0.0 106.808 -177.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.2 p . . . . . 0 C--N 1.321 -0.671 0 O-C-N 120.343 -1.473 . . . . 0.0 112.068 174.652 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 . . . . . 0 N--CA 1.447 -0.603 0 N-CA-C 103.994 -2.595 . . . . 0.0 103.994 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -116.49 114.16 45.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -158.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 72.9 mmm -104.72 118.49 36.7 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.2 m -123.72 135.29 53.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.819 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.27 135.88 53.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 123.714 0.806 . . . . 0.0 109.671 -158.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.0 t -104.13 112.85 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.0 t -137.96 136.35 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.893 2.077 . . . . 0.0 107.963 -164.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.1 t70 59.83 -65.62 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 127.213 2.205 . . . . 0.0 114.167 -171.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -174.92 20.66 0.05 OUTLIER Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.117 2.77 . . . . 0.0 112.033 174.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.09 166.84 22.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 127.248 2.219 . . . . 0.0 109.613 -167.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -121.87 138.53 54.36 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.995 0.918 . . . . 0.0 111.779 -175.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -134.77 148.3 50.2 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.083 1.753 . . . . 0.0 109.519 -173.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -133.94 131.49 39.09 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.618 1.167 . . . . 0.0 109.985 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -129.37 113.45 1.52 Allowed Glycine 0 CA--C 1.522 0.474 0 C-N-CA 125.077 1.322 . . . . 0.0 111.381 -173.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -104.81 104.69 14.51 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.115 0.966 . . . . 0.0 111.171 -172.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.01 137.97 9.54 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 124.496 1.046 . . . . 0.0 115.42 -176.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -35.76 -44.41 0.34 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 115.383 1.623 . . . . 0.0 115.383 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -139.97 179.19 6.75 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.292 1.037 . . . . 0.0 111.171 158.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 54.2 mttp -47.25 -35.1 7.25 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 126.589 1.955 . . . . 0.0 115.838 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.07 -15.4 5.21 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.5 tp -124.04 -41.74 2.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.267 2.227 . . . . 0.0 110.728 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.432 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.7 -58.27 8.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.967 1.307 . . . . 0.0 112.912 172.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.531 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.0 ttmt -55.25 -46.34 76.08 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-O 116.886 -1.531 . . . . 0.0 110.127 169.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.59 75.0 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 121.594 1.997 . . . . 0.0 113.174 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -55.39 -57.5 11.61 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 170.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.93 49.92 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.489 0.716 . . . . 0.0 112.574 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.19 -59.11 4.25 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.635 2.374 . . . . 0.0 112.455 172.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.12 -49.42 71.82 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.998 1.272 . . . . 0.0 111.687 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.7 m -55.42 -55.07 35.87 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.029 0.932 . . . . 0.0 112.542 175.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -55.74 27.8 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.769 1.228 . . . . 0.0 111.841 175.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.42 -57.82 2.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.481 2.312 . . . . 0.0 110.68 175.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.87 -54.17 45.98 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 122.834 0.454 . . . . 0.0 111.638 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.3 m -55.15 -68.69 0.17 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.278 21.1 m -55.51 -46.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -57.74 -46.66 84.17 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.72 -36.79 67.62 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.391 1.45 . . . . 0.0 113.635 169.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.548 0.894 0 C-N-CA 124.864 1.265 . . . . 0.0 111.466 169.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo . . . . . 0 C--O 1.236 0.38 0 N-CA-C 115.275 1.221 . . . . 0.0 115.275 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.449 HG22 ' HB3' ' A' ' 55' ' ' LYS . 59.5 t -46.87 -58.59 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.117 0.967 . . . . 0.0 109.264 169.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.0 tpp -55.69 -43.91 76.85 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.7 1.6 . . . . 0.0 114.412 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.1 mt -55.59 -59.67 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.389 0.995 . . . . 0.0 110.928 173.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.419 ' HB2' HD13 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -50.28 -48.41 54.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.489 1.516 . . . . 0.0 111.236 176.278 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -57.89 -55.38 35.59 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 124.72 1.208 . . . . 0.0 113.881 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -56.45 -45.3 80.89 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.274 1.83 . . . . 0.0 113.765 174.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.58 -37.68 68.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.201 1.8 . . . . 0.0 112.951 169.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.8 ptt-85 34.8 66.4 1.49 Allowed Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 127.63 2.372 . . . . 0.0 114.412 -178.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.71 60.64 1.19 Allowed 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 124.922 3.748 . . . . 0.0 113.06 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.92 25.99 64.81 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.019 1.771 . . . . 0.0 115.064 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.413 ' HB3' HG12 ' A' ' 39' ' ' VAL . 1.1 pp -79.06 162.05 26.15 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 116.432 2.012 . . . . 0.0 116.432 -159.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -135.21 137.18 42.39 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.303 2.241 . . . . 0.0 110.713 164.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -104.39 135.32 46.05 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 124.587 1.18 . . . . 0.0 111.465 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -121.28 135.57 55.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 127.614 2.366 . . . . 0.0 109.68 -177.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -104.49 124.16 48.78 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 122.772 1.272 . . . . 0.0 109.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.429 ' CB ' HG13 ' A' ' 34' ' ' VAL . 1.3 mm? -123.84 159.46 29.53 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 130.239 3.416 . . . . 0.0 103.645 178.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.6 p . . . . . 0 N--CA 1.473 0.711 0 O-C-N 118.753 -2.467 . . . . 0.0 112.847 167.309 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 . . . . . 0 N--CA 1.45 -0.457 0 CA-C-O 121.766 0.793 . . . . 0.0 109.607 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . 0.429 HG13 ' CB ' ' A' ' 22' ' ' LEU 0.258 0.1 OUTLIER -104.96 134.5 46.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 122.843 1.306 . . . . 0.0 111.768 167.38 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 67.1 mmm -117.76 127.13 53.61 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -122.96 135.24 54.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -119.58 135.71 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 111.076 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.8 t -102.25 124.67 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 104.87 -2.27 . . . . 0.0 104.87 161.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.413 HG12 ' HB3' ' A' ' 17' ' ' LEU . 4.8 m -138.29 150.28 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.936 2.094 . . . . 0.0 108.159 -173.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.2 t70 54.97 -79.28 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 125.204 1.401 . . . . 0.0 113.552 -175.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -159.67 20.9 0.27 Allowed Glycine 0 CA--C 1.544 1.844 0 C-N-CA 127.988 2.709 . . . . 0.0 112.5 167.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -135.13 170.29 16.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.834 2.453 . . . . 0.0 112.583 -172.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -134.5 136.44 43.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.92 0.888 . . . . 0.0 112.991 -162.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.421 ' HZ ' HG21 ' A' ' 65' ' ' THR . 44.1 m-85 -134.98 149.6 50.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.049 1.74 . . . . 0.0 111.102 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -132.27 125.95 32.24 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.897 1.279 . . . . 0.0 109.846 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.05 112.91 2.12 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 126.019 1.771 . . . . 0.0 111.569 -169.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -104.9 112.84 26.12 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.432 1.116 . . . . 0.0 111.059 -170.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.69 136.42 8.46 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 125.694 1.616 . . . . 0.0 116.702 -165.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.1 mmm-85 -55.51 -13.81 1.72 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 170.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -152.88 165.59 34.96 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 128.186 2.594 . . . . 0.0 109.139 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -51.37 -42.83 61.63 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 121.158 1.799 . . . . 0.0 113.376 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -5.7 3.44 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 174.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.58 -50.93 3.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.214 1.406 . . . . 0.0 109.067 170.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.36 -59.4 4.85 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.594 1.958 . . . . 0.0 113.459 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HB3' HG22 ' A' ' 7' ' ' VAL . 6.7 mmtt -55.53 -38.34 69.11 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 115.479 -2.2 . . . . 0.0 113.081 163.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 -50.77 68.89 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 123.462 2.847 . . . . 0.0 111.944 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -55.34 -58.25 8.49 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.269 3.428 . . . . 0.0 113.347 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.4 -56.31 21.6 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.066 1.347 . . . . 0.0 111.593 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.68 -55.28 11.77 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 168.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -55.1 -47.75 74.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 120.822 1.646 . . . . 0.0 112.911 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -55.12 -56.69 16.98 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.54 1.136 . . . . 0.0 112.298 172.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -55.04 35.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.638 1.175 . . . . 0.0 112.279 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.419 HD13 ' HB2' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -48.37 -60.83 2.36 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.762 2.425 . . . . 0.0 109.8 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.09 -48.45 73.55 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.774 0.43 . . . . 0.0 111.31 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.421 HG21 ' HZ ' ' A' ' 44' ' ' PHE . 49.2 m -55.37 -69.3 0.14 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.772 1.026 . . . . 0.0 113.772 173.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.4 m -55.27 -41.33 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.287 0.948 . . . . 0.0 112.957 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.23 -45.24 80.05 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.82 -1.175 . . . . 0.0 113.724 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -36.53 67.2 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 164.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.4 mt . . . . . 0 N--CA 1.484 1.238 0 CA-C-N 119.518 1.054 . . . . 0.0 112.598 169.65 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo . . . . . 0 C--O 1.237 0.469 0 N-CA-C 114.77 1.027 . . . . 0.0 114.77 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.712 HG13 ' HG2' ' A' ' 55' ' ' LYS . 57.3 t -55.06 -50.28 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 173.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.08 -45.06 75.37 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.682 1.193 . . . . 0.0 113.208 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 12.2 mt -55.65 -63.6 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.342 1.057 . . . . 0.0 110.874 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -41.69 72.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.964 0.906 . . . . 0.0 112.842 -176.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.36 -63.64 1.1 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.093 1.757 . . . . 0.0 111.442 174.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -56.01 -48.9 75.05 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.403 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 1.7 mt -55.66 -35.0 65.48 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 172.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 ptt-85 33.94 59.16 1.95 Allowed Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 127.259 2.224 . . . . 0.0 115.2 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -68.01 70.78 0.84 Allowed 'Trans proline' 0 CA--C 1.548 1.203 0 C-N-CA 124.665 3.577 . . . . 0.0 114.241 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.16 30.02 74.58 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.966 1.746 . . . . 0.0 114.911 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -99.6 163.88 12.31 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 117.115 2.265 . . . . 0.0 117.115 -156.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.37 141.95 45.64 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 127.127 2.171 . . . . 0.0 112.065 161.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.428 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 29.7 m-85 -104.57 135.24 46.35 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.413 1.102 . . . . 0.0 110.874 176.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -107.46 135.73 48.44 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 128.478 2.711 . . . . 0.0 109.9 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -104.61 127.98 52.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 122.751 1.262 . . . . 0.0 110.352 174.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.9 135.83 41.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 130.014 3.326 . . . . 0.0 106.11 -171.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 t . . . . . 0 C--N 1.321 -0.662 0 N-CA-C 118.476 2.769 . . . . 0.0 118.476 -166.691 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 . . . . . 0 CA--C 1.512 -0.488 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.9 t -115.31 125.64 72.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 123.382 1.563 . . . . 0.0 108.696 -161.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.6 mmt -112.34 122.58 48.13 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.019 -1.446 . . . . 0.0 107.731 173.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -122.82 135.52 54.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.428 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -128.62 135.68 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.14 0.976 . . . . 0.0 111.365 -168.113 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.5 t -104.23 122.96 57.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 105.619 -1.993 . . . . 0.0 105.619 166.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -142.33 151.08 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.325 1.85 . . . . 0.0 108.37 -175.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.5 t70 58.01 -70.5 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.328 1.851 . . . . 0.0 114.13 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.22 18.45 0.09 OUTLIER Glycine 0 CA--C 1.543 1.817 0 C-N-CA 128.037 2.732 . . . . 0.0 112.946 167.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -135.33 169.45 17.46 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.756 2.422 . . . . 0.0 112.382 -168.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -134.21 138.83 45.38 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.466 1.106 . . . . 0.0 113.524 -166.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -135.12 158.75 43.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.874 1.67 . . . . 0.0 112.318 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -128.75 135.05 48.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.892 2.077 . . . . 0.0 109.449 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.86 122.21 3.13 Favored Glycine 0 CA--C 1.524 0.646 0 C-N-CA 125.494 1.521 . . . . 0.0 111.304 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 m -118.07 104.74 11.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 117.896 0.848 . . . . 0.0 110.903 -168.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 146.2 18.19 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.43 1.967 . . . . 0.0 114.347 -170.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -44.71 -33.06 1.71 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -155.51 179.31 9.3 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.881 1.672 . . . . 0.0 109.684 162.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.5 mtmt -43.39 -41.87 4.39 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 127.636 2.374 . . . . 0.0 115.709 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.99 -15.92 4.16 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 174.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -122.92 -42.48 2.29 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.931 2.092 . . . . 0.0 111.297 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.42 -57.89 10.02 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.227 1.411 . . . . 0.0 112.295 172.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.712 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.7 ttmt -55.37 -44.46 76.05 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-O 117.586 -1.197 . . . . 0.0 110.863 170.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 -51.9 65.0 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 120.341 1.428 . . . . 0.0 113.463 178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.6 mmm-85 -55.36 -53.39 56.8 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.164 1.785 . . . . 0.0 113.24 170.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.79 65.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.97 0.908 . . . . 0.0 112.319 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.71 67.63 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 127.298 2.239 . . . . 0.0 112.403 171.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -55.01 -51.01 67.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.234 1.414 . . . . 0.0 111.822 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -55.26 -54.0 48.97 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.868 0.867 . . . . 0.0 112.812 171.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.23 -55.95 25.48 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.611 1.165 . . . . 0.0 113.19 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -59.8 3.5 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 127.826 2.45 . . . . 0.0 110.545 177.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.23 -49.6 69.07 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.177 0.298 . . . . 0.0 111.078 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 44.8 m -55.28 -72.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.541 1.136 . . . . 0.0 113.98 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.251 24.4 m -55.54 -46.17 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.403 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 5.8 m-30 -59.64 -44.69 93.41 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 174.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -55.58 -39.36 70.6 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.916 1.235 . . . . 0.0 113.887 168.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.552 1.041 0 C-N-CA 125.579 1.552 . . . . 0.0 112.215 167.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo . . . . . 0 CA--C 1.529 0.231 0 CA-C-O 118.649 -0.646 . . . . 0.0 113.627 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.711 HG13 ' HG2' ' A' ' 55' ' ' LYS . 60.4 t -55.07 -50.3 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.165 0.893 . . . . 0.0 109.214 173.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.28 -53.6 54.07 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.944 1.298 . . . . 0.0 114.271 -177.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 15.0 pt -58.71 -49.88 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 172.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.4 ' HB2' ' CD1' ' A' ' 63' ' ' LEU 0.252 0.0 OUTLIER -55.59 -45.33 77.42 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.663 1.12 . . . . 0.0 113.838 176.981 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.13 -56.46 19.67 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 127.106 2.163 . . . . 0.0 111.432 174.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.61 -63.82 1.05 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.111 1.364 . . . . 0.0 114.042 173.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.7 mt -55.54 -23.73 28.2 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 35.92 51.21 1.5 Allowed Pre-proline 0 N--CA 1.48 1.07 0 C-N-CA 127.557 2.343 . . . . 0.0 114.778 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.73 46.85 1.99 Allowed 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 124.657 3.571 . . . . 0.0 116.012 -156.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.04 20.16 Favored Glycine 0 CA--C 1.534 1.251 0 O-C-N 120.521 -1.362 . . . . 0.0 113.538 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -97.58 166.27 11.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.774 1.63 . . . . 0.0 114.933 -173.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.63 150.77 49.74 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.299 1.44 . . . . 0.0 112.654 145.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.55 135.83 45.25 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.842 1.257 . . . . 0.0 112.145 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -124.66 135.72 53.31 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.695 1.598 . . . . 0.0 110.266 166.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -104.42 135.14 46.42 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 123.381 1.562 . . . . 0.0 110.678 -175.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -134.5 161.74 34.21 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 131.691 3.996 . . . . 0.0 106.1 -164.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.7 m . . . . . 0 C--N 1.319 -0.759 0 O-C-N 119.64 -1.913 . . . . 0.0 112.488 158.026 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 104.488 -2.412 . . . . 0.0 104.488 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 69.2 t -120.76 130.07 74.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.29 1.043 . . . . 0.0 110.841 -159.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 13.5 mmm -109.22 123.23 48.91 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 171.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.6 p -104.88 135.62 45.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.227 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -125.25 135.47 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.788 -0.57 . . . . 0.0 111.264 172.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.3 t -104.54 124.16 58.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 165.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.4 p -152.28 140.96 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.305 1.042 . . . . 0.0 110.174 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.5 t70 62.3 -25.16 0.05 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.937 2.095 . . . . 0.0 116.327 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 133.17 -4.76 4.95 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 126.939 2.209 . . . . 0.0 112.886 -165.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -105.02 168.02 9.33 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.223 2.209 . . . . 0.0 110.808 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -135.09 139.89 45.08 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.076 1.35 . . . . 0.0 110.643 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -135.06 150.84 50.34 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.529 1.132 . . . . 0.0 111.041 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -115.29 135.09 54.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.025 1.73 . . . . 0.0 109.351 166.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.62 114.22 2.79 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 125.11 1.338 . . . . 0.0 110.373 168.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.8 p -104.83 108.86 20.57 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 122.577 1.18 . . . . 0.0 109.601 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.44 140.8 11.97 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 126.192 1.853 . . . . 0.0 113.283 -165.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -17.07 6.16 Favored 'General case' 0 CA--C 1.557 1.237 0 O-C-N 121.291 -1.123 . . . . 0.0 113.947 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -160.42 162.24 33.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 129.429 3.092 . . . . 0.0 109.584 170.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.46 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 50.2 mttp -43.93 -37.73 3.04 Favored 'General case' 0 N--CA 1.5 2.063 0 CA-C-N 121.707 2.048 . . . . 0.0 115.455 172.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -14.43 7.4 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 120.159 1.345 . . . . 0.0 114.218 174.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.0 tp -122.24 -40.0 2.53 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.294 2.238 . . . . 0.0 111.897 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.67 -55.25 34.33 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.405 -1.434 . . . . 0.0 111.737 173.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.711 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.5 ttmt -55.32 -41.84 72.96 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-O 117.785 -1.102 . . . . 0.0 111.768 168.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.58 -50.78 69.17 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 120.429 1.468 . . . . 0.0 113.677 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -55.5 -54.06 48.66 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 128.563 2.745 . . . . 0.0 112.661 169.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -53.82 51.39 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.869 1.268 . . . . 0.0 111.672 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.43 -56.82 8.39 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 126.794 2.038 . . . . 0.0 112.269 169.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -52.64 -49.41 65.24 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.112 1.365 . . . . 0.0 112.525 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.22 -57.94 9.72 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.105 1.362 . . . . 0.0 112.165 173.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.464 ' O ' HG22 ' A' ' 66' ' ' VAL . . . -55.18 -56.73 16.62 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.651 1.18 . . . . 0.0 112.354 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.4 ' CD1' ' HB2' ' A' ' 10' ' ' LEU . 0.4 OUTLIER -44.5 -63.82 0.82 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 128.208 2.603 . . . . 0.0 110.82 176.728 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.48 -51.65 62.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 117.82 0.282 . . . . 0.0 110.94 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.0 m -55.3 -78.25 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 62' ' ' ALA . 15.8 m -55.25 -45.75 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.433 1.015 . . . . 0.0 113.179 -174.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -57.64 -45.42 85.49 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.755 -1.215 . . . . 0.0 112.539 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . 0.319 8.1 t-20 -57.26 -31.25 65.39 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 164.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.1 mt . . . . . 0 N--CA 1.477 0.876 0 CA-C-N 119.709 1.14 . . . . 0.0 113.647 170.001 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo . . . . . 0 CA--C 1.527 0.157 0 N-CA-C 115.366 1.256 . . . . 0.0 115.366 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.742 HG13 ' HG2' ' A' ' 55' ' ' LYS . 46.1 t -53.87 -53.65 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.26 0.936 . . . . 0.0 109.208 173.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.3 ttt -55.53 -41.05 72.64 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.352 1.861 . . . . 0.0 114.728 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.1 mt -62.2 -59.21 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.789 1.635 . . . . 0.0 112.727 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -55.48 -35.97 66.11 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.622 0.769 . . . . 0.0 112.426 177.953 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -55.54 -58.37 8.05 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.954 1.702 . . . . 0.0 112.945 162.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.45 -49.69 71.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.038 -1.664 . . . . 0.0 113.317 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.432 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 8.0 mt -55.91 -42.38 75.94 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 170.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 11.12 80.05 0.06 OUTLIER Pre-proline 0 N--CA 1.49 1.526 0 C-N-CA 129.158 2.983 . . . . 0.0 115.321 -175.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -68.97 -173.18 0.57 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.612 2.208 . . . . 0.0 110.516 161.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -71.36 39.9 0.59 Allowed Glycine 0 CA--C 1.541 1.682 0 C-N-CA 125.202 1.382 . . . . 0.0 115.168 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -78.6 163.31 25.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.655 1.582 . . . . 0.0 112.968 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -135.54 135.95 40.77 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -104.37 135.55 45.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.033 1.333 . . . . 0.0 111.046 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.52 135.91 50.45 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 129.415 3.086 . . . . 0.0 110.367 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -104.32 128.21 52.09 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 122.66 1.219 . . . . 0.0 109.984 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.8 mp -135.03 135.74 41.56 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 129.244 3.018 . . . . 0.0 106.599 -170.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--N 1.319 -0.748 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -160.563 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 CA--C 1.504 -0.801 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.0 t -110.14 122.45 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 CA-C-N 113.384 -1.735 . . . . 0.0 106.793 -169.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 69.0 mmm -113.62 128.79 56.56 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 172.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -131.7 135.14 46.62 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.681 0.613 . . . . 0.0 110.185 -175.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -127.48 135.75 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 121.03 -1.044 . . . . 0.0 110.37 -167.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.16 118.26 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 105.115 -2.179 . . . . 0.0 105.115 168.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -118.69 -35.95 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.349 -159.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -131.26 -13.6 3.45 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.265 . . . . 0.0 113.884 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.33 -17.19 29.07 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 123.905 0.764 . . . . 0.0 112.096 -147.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -104.69 158.92 16.17 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 125.231 1.412 . . . . 0.0 110.747 163.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -135.08 141.09 46.0 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.043 1.737 . . . . 0.0 111.581 -161.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -134.99 127.54 30.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.977 1.311 . . . . 0.0 111.62 -171.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -99.23 135.17 41.02 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.215 1.806 . . . . 0.0 109.251 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.05 115.96 1.48 Allowed Glycine 0 CA--C 1.525 0.669 0 O-C-N 121.65 -0.656 . . . . 0.0 113.381 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.7 p -104.89 104.73 14.54 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.18 1.392 . . . . 0.0 111.533 -174.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.4 ' HA3' ' N ' ' A' ' 54' ' ' ALA . . . -135.95 147.27 19.12 Favored Glycine 0 CA--C 1.528 0.906 0 N-CA-C 116.266 1.266 . . . . 0.0 116.266 -173.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -47.91 -26.33 1.67 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -152.83 -174.26 4.86 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.824 1.25 . . . . 0.0 109.344 149.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.433 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 6.6 mtmp? -42.36 -38.92 1.99 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 126.522 1.929 . . . . 0.0 114.234 172.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -45.61 -30.09 1.41 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.482 1.913 . . . . 0.0 115.52 171.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.5 tp -122.28 -36.49 2.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 111.466 -175.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.433 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.72 -56.31 22.02 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.39 1.476 . . . . 0.0 112.154 170.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.742 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.2 ttmt -55.02 -46.08 75.22 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 117.228 -1.368 . . . . 0.0 109.425 169.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -49.19 72.85 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 120.664 1.574 . . . . 0.0 113.064 -179.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -55.35 -57.36 12.17 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.824 0.849 . . . . 0.0 113.209 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.47 66.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.308 0.643 . . . . 0.0 112.325 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.39 -53.77 49.55 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.969 2.508 . . . . 0.0 113.372 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -55.3 -51.44 66.68 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.149 1.34 . . . . 0.0 111.389 176.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.2 m -55.38 -49.34 72.57 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.598 1.159 . . . . 0.0 112.115 177.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.44 ' O ' HG23 ' A' ' 66' ' ' VAL . . . -55.19 -65.7 0.54 Allowed 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.393 1.477 . . . . 0.0 111.477 170.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -37.47 -57.71 0.91 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.704 2.002 . . . . 0.0 111.988 177.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.12 -62.55 1.59 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 m -55.45 -54.17 47.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 62' ' ' ALA . 49.8 t -55.02 -62.98 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 127.391 2.276 . . . . 0.0 109.733 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.432 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 2.7 m-30 -57.29 -42.14 81.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.78 -38.66 70.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.839 0.856 . . . . 0.0 112.448 170.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.548 0.896 0 C-N-CA 124.124 0.969 . . . . 0.0 109.9 165.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo . . . . . 0 C--O 1.235 0.364 0 N-CA-C 114.01 0.734 . . . . 0.0 114.01 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.555 HG13 ' HG2' ' A' ' 55' ' ' LYS . 78.3 t -53.82 -54.96 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 122.351 1.072 . . . . 0.0 108.124 171.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 tpt -55.62 -50.38 70.31 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 126.274 1.83 . . . . 0.0 115.816 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 9.6 pt -57.72 -51.15 73.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 120.768 1.622 . . . . 0.0 113.576 167.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.302 0.0 OUTLIER -55.57 -45.02 77.37 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.02 1.282 . . . . 0.0 114.094 179.459 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -55.32 -53.95 49.73 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.998 2.519 . . . . 0.0 112.685 170.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -55.51 -57.06 13.48 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.478 1.111 . . . . 0.0 113.153 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.39 -44.77 76.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.92 1.688 . . . . 0.0 114.769 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 35.43 65.81 1.76 Allowed Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.245 1.818 . . . . 0.0 114.93 -168.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.53 78.53 0.18 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.317 2.678 . . . . 0.0 113.196 168.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.61 27.54 66.34 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 126.362 1.934 . . . . 0.0 115.992 171.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 pp -106.35 158.16 17.08 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 117.318 2.34 . . . . 0.0 117.318 -155.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 135.87 40.02 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 127.691 2.396 . . . . 0.0 113.608 168.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -104.59 135.4 46.06 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.293 1.037 . . . . 0.0 111.437 176.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -104.89 135.65 45.84 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.354 1.862 . . . . 0.0 109.186 164.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -104.64 130.8 52.61 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 122.764 1.268 . . . . 0.0 110.513 170.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.54 151.28 49.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 129.741 3.216 . . . . 0.0 106.025 -172.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 33' ' ' PHE . 67.4 m . . . . . 0 C--N 1.318 -0.779 0 O-C-N 120.843 -1.16 . . . . 0.0 109.025 149.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.65 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 25.6 t -108.57 131.63 58.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.909 -160.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.7 mmt -104.7 124.23 49.01 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 169.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.16 134.79 55.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.4 135.81 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.503 -169.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.1 t -104.22 120.6 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.3 t -142.99 134.05 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.91 1.684 . . . . 0.0 108.863 -162.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 t70 56.66 -66.93 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 127.751 2.42 . . . . 0.0 113.854 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.68 19.26 0.06 OUTLIER Glycine 0 CA--C 1.54 1.618 0 C-N-CA 128.576 2.989 . . . . 0.0 111.942 174.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -126.62 176.33 7.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.959 2.504 . . . . 0.0 109.252 -170.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -130.67 134.67 47.13 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.996 0.919 . . . . 0.0 111.901 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -135.0 150.24 50.31 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.416 1.486 . . . . 0.0 111.177 -173.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.23 135.1 30.36 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.474 1.11 . . . . 0.0 111.019 -173.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.79 120.73 2.73 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.731 1.634 . . . . 0.0 111.048 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 p -104.96 104.69 14.48 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.421 1.088 . . . . 0.0 110.47 -176.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.56 135.72 8.03 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 115.044 0.778 . . . . 0.0 115.044 -166.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -62.27 -1.98 0.88 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 170.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -161.2 158.56 27.58 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.561 2.344 . . . . 0.0 108.963 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -55.56 -32.73 63.26 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 121.028 1.74 . . . . 0.0 114.943 170.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -5.32 5.19 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 121.629 2.013 . . . . 0.0 115.247 169.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.7 tp -117.85 -52.44 2.43 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.412 1.885 . . . . 0.0 110.53 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.3 -53.89 50.38 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.372 1.469 . . . . 0.0 112.501 173.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.555 ' HG2' HG13 ' A' ' 7' ' ' VAL . 4.3 ttmt -55.5 -47.79 75.65 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 117.462 -1.256 . . . . 0.0 112.294 168.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -48.51 74.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 120.474 1.488 . . . . 0.0 112.529 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.6 mmm-85 -54.96 -59.47 4.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 129.228 3.011 . . . . 0.0 113.291 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -50.2 70.41 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.924 0.89 . . . . 0.0 112.457 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.93 -52.3 63.39 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 126.245 1.818 . . . . 0.0 112.8 172.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -52.65 -50.47 63.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.941 1.696 . . . . 0.0 111.843 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.2 m -55.33 -55.08 35.66 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.646 1.178 . . . . 0.0 112.193 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.05 -61.12 2.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 112.224 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -44.64 -60.12 2.15 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.791 2.436 . . . . 0.0 111.49 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.29 -53.25 56.35 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 117.886 0.312 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.8 m -55.25 -73.83 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.264 4.9 m -55.66 -47.11 79.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 124.8 1.24 . . . . 0.0 114.081 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -57.15 -47.23 81.69 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -55.45 -38.37 68.94 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.665 1.12 . . . . 0.0 112.946 172.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.547 0.839 0 C-N-CA 125.001 1.32 . . . . 0.0 110.36 167.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo . . . . . 0 C--O 1.238 0.509 0 N-CA-C 114.355 0.867 . . . . 0.0 114.355 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 13.3 t -55.1 -48.76 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -43.35 75.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.04 1.336 . . . . 0.0 114.525 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.5 mt -55.89 -61.06 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.744 1.218 . . . . 0.0 111.517 168.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.258 0.0 OUTLIER -55.27 -37.85 67.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.787 0.803 . . . . 0.0 112.806 -179.194 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -55.4 -56.98 13.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.954 2.102 . . . . 0.0 113.263 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -55.3 -53.33 57.53 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.95 2.1 . . . . 0.0 112.508 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -40.95 72.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.588 2.755 . . . . 0.0 115.078 173.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.331 0.0 OUTLIER 5.42 80.81 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 129.337 3.055 . . . . 0.0 118.055 -168.371 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.05 -175.83 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 124.311 3.341 . . . . 0.0 114.995 163.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.03 83.03 0.07 OUTLIER Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.121 -0.987 . . . . 0.0 111.507 162.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.32 160.7 33.14 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -175.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -135.7 135.78 40.34 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.826 2.05 . . . . 0.0 113.438 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -104.53 135.55 45.73 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.805 1.242 . . . . 0.0 110.668 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -125.99 135.73 52.16 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.91 2.084 . . . . 0.0 109.985 -178.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -104.63 131.47 52.02 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.509 1.147 . . . . 0.0 111.332 -172.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -134.94 135.63 41.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 128.848 2.859 . . . . 0.0 107.342 -175.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 p . . . . . 0 C--N 1.319 -0.741 0 O-C-N 119.86 -1.775 . . . . 0.0 112.663 159.744 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 . . . . . 0 C--O 1.232 0.143 0 N-CA-C 105.315 -2.106 . . . . 0.0 105.315 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.0 t -122.57 115.79 47.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.14 -157.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 82.1 mmm -104.9 117.34 33.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.834 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p -104.88 135.52 46.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.778 177.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.12 135.55 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.673 -0.642 . . . . 0.0 110.207 -172.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.2 t -104.27 116.46 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 169.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 63.1 t -137.67 123.33 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.487 1.515 . . . . 0.0 108.46 -165.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.8 t70 63.88 -29.44 0.1 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 127.244 2.218 . . . . 0.0 116.2 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 139.93 -5.81 2.82 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.555 1.55 . . . . 0.0 113.056 -161.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -104.95 167.92 9.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.101 2.161 . . . . 0.0 110.117 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -134.55 139.11 45.15 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.754 0.822 . . . . 0.0 112.227 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -135.04 158.99 42.93 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.435 1.494 . . . . 0.0 112.161 -176.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -135.45 121.67 20.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.23 1.812 . . . . 0.0 108.983 171.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -114.79 105.25 1.48 Allowed Glycine 0 CA--C 1.52 0.364 0 C-N-CA 126.013 1.768 . . . . 0.0 109.644 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -105.28 104.36 14.08 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.76 0.791 . . . . 0.0 110.126 -170.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.11 136.37 8.38 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.966 1.746 . . . . 0.0 114.36 -169.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -48.35 -26.72 2.17 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.487 ' HB3' ' HE2' ' A' ' 52' ' ' LYS . 20.3 t-20 -150.36 166.29 30.49 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 125.775 1.63 . . . . 0.0 111.072 169.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -46.61 -46.84 19.94 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.355 1.434 . . . . 0.0 114.407 -175.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.487 ' HE2' ' HB3' ' A' ' 50' ' ' ASN . 0.0 OUTLIER -58.47 -5.81 0.59 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 116.096 1.887 . . . . 0.0 116.096 175.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.6 tp -120.11 -42.89 2.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.296 2.238 . . . . 0.0 110.869 173.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.43 -59.57 4.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.089 1.356 . . . . 0.0 112.507 171.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -55.46 -39.83 70.85 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-O 115.455 -2.212 . . . . 0.0 112.984 164.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.28 -52.1 64.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 123.37 2.805 . . . . 0.0 111.907 178.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.23 -54.29 45.28 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.503 1.921 . . . . 0.0 114.078 169.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -58.37 8.05 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.29 -51.93 13.63 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 125.034 1.334 . . . . 0.0 114.105 167.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -55.13 -51.37 66.64 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.226 1.41 . . . . 0.0 112.052 178.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.2 m -55.28 -53.06 60.82 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.705 1.202 . . . . 0.0 111.831 174.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -61.7 2.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.229 175.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.59 -60.11 2.14 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 127.3 2.24 . . . . 0.0 110.97 178.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.05 -52.4 63.31 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.212 0.205 . . . . 0.0 111.495 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 m -55.36 -69.02 0.15 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.297 32.8 m -55.39 -47.13 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -176.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -56.73 -38.53 72.5 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -55.93 -44.97 78.84 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.126 1.33 . . . . 0.0 111.659 171.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.257 3.5 pp . . . . . 0 CA--C 1.541 0.627 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 175.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo . . . . . 0 C--O 1.236 0.391 0 N-CA-C 114.752 1.02 . . . . 0.0 114.752 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.479 HG13 ' HG2' ' A' ' 55' ' ' LYS . 74.8 t -55.1 -48.06 76.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.464 0 CA-C-N 118.264 0.484 . . . . 0.0 109.729 176.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.47 -42.53 74.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.913 1.285 . . . . 0.0 114.112 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.425 ' H ' HG13 ' A' ' 9' ' ' ILE . 3.5 mt -55.98 -59.26 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.299 1.04 . . . . 0.0 113.091 167.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.27 0.0 OUTLIER -55.4 -37.5 67.67 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.348 0.659 . . . . 0.0 112.062 -179.308 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -55.35 -61.81 2.09 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.461 2.304 . . . . 0.0 112.67 164.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.52 -53.4 56.8 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.187 -0.945 . . . . 0.0 112.343 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.419 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 11.8 mt -56.92 -40.22 75.92 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 171.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.42 0.0 OUTLIER 0.91 73.52 0.04 OUTLIER Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 127.831 2.452 . . . . 0.0 117.032 -160.619 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.08 64.06 5.15 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 124.346 3.364 . . . . 0.0 113.864 -173.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.08 27.34 73.72 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.739 1.161 . . . . 0.0 114.843 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -91.66 167.82 11.93 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.749 1.619 . . . . 0.0 113.676 -171.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -135.22 136.47 41.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.456 1.502 . . . . 0.0 113.367 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -104.32 135.4 45.85 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.045 0.938 . . . . 0.0 110.827 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -123.81 120.6 33.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.679 1.992 . . . . 0.0 109.158 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -104.95 131.56 52.3 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.551 1.14 . . . . 0.0 111.787 -167.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.38 168.48 18.51 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 126.669 1.988 . . . . 0.0 106.629 -179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.1 p . . . . . 0 C--N 1.311 -1.066 0 O-C-N 119.594 -1.941 . . . . 0.0 111.426 -179.607 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 N--CA 1.462 0.147 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.49 129.29 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-O 122.931 1.348 . . . . 0.0 114.507 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.29 125.38 53.82 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 120.678 -1.264 . . . . 0.0 110.154 -176.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.5 p -114.5 142.74 46.01 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 124.351 1.061 . . . . 0.0 111.708 177.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.18 135.94 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 120.891 -1.131 . . . . 0.0 110.973 -175.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.18 118.28 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 170.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -132.92 -33.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -158.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -137.59 13.35 2.97 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 122.221 1.01 . . . . 0.0 113.484 -160.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.29 -11.25 31.44 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -153.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -105.15 164.29 11.93 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 128.219 2.608 . . . . 0.0 110.862 175.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -129.83 138.68 51.13 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.301 1.84 . . . . 0.0 109.811 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -132.51 152.94 51.39 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.658 1.583 . . . . 0.0 109.194 -174.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -140.68 135.27 31.47 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.236 1.014 . . . . 0.0 111.178 173.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.66 122.79 4.67 Favored Glycine 0 CA--C 1.523 0.566 0 C-N-CA 126.519 2.009 . . . . 0.0 111.284 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 t -104.91 119.69 39.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.78 0.832 . . . . 0.0 110.549 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.28 149.14 20.82 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 125.104 1.335 . . . . 0.0 116.06 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -48.98 -26.16 2.37 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 175.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -161.15 -176.27 5.35 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.11 1.764 . . . . 0.0 108.78 152.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 28.5 mtmm -45.76 -38.66 7.27 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.943 2.097 . . . . 0.0 115.33 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -16.13 4.38 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 173.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.4 tp -123.38 -40.41 2.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.149 2.18 . . . . 0.0 111.786 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.69 -57.64 11.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.103 1.361 . . . . 0.0 112.291 171.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.479 ' HG2' HG13 ' A' ' 7' ' ' VAL . 8.6 ttmt -55.14 -45.82 75.65 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-O 116.61 -1.662 . . . . 0.0 109.376 169.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.44 75.44 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 121.994 2.179 . . . . 0.0 113.441 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -55.51 -57.82 10.31 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.815 0.846 . . . . 0.0 112.858 170.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.36 -52.27 64.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.082 0.953 . . . . 0.0 112.164 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.06 -58.37 6.76 Favored 'General case' 0 C--O 1.215 -0.723 0 C-N-CA 128.247 2.619 . . . . 0.0 111.978 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.04 -47.43 74.79 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 120.133 1.333 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 m -55.29 -55.63 29.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.22 1.008 . . . . 0.0 112.141 175.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -53.28 58.02 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.809 1.244 . . . . 0.0 112.839 173.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.87 -61.66 1.85 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 128.055 2.542 . . . . 0.0 110.325 176.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.31 -46.29 72.79 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 122.93 0.492 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.4 m -55.14 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.552 0.741 . . . . 0.0 112.767 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.0 m -55.45 -40.0 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -176.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.419 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 4.7 m-30 -59.84 -43.76 94.44 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 113.959 172.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -35.37 65.92 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.258 1.39 . . . . 0.0 113.811 163.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 N--CA 1.481 1.099 0 CA-C-N 119.324 0.966 . . . . 0.0 113.334 170.668 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 N--CA 1.461 -0.415 0 N-CA-C 113.901 0.693 . . . . 0.0 113.901 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 55' ' ' LYS . 93.5 t -52.76 -55.01 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 122.664 1.221 . . . . 0.0 108.88 173.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.2 tpt -55.79 -51.49 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 10.4 pt -55.67 -47.71 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 166.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.283 0.0 OUTLIER -55.63 -43.1 75.85 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.08 -54.59 41.2 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 112.031 172.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.53 -64.14 0.94 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.428 1.891 . . . . 0.0 112.739 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.281 50.6 mt -56.08 -25.21 44.45 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 116.369 1.989 . . . . 0.0 116.369 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER 22.64 61.38 0.33 Allowed Pre-proline 0 N--CA 1.491 1.583 0 C-N-CA 129.038 2.935 . . . . 0.0 116.495 -178.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.44 39.59 0.42 Allowed 'Trans proline' 0 CA--C 1.555 1.56 1 C-N-CA 125.416 4.078 . . . . 0.0 117.169 -160.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.66 32.22 13.79 Favored Glycine 0 CA--C 1.534 1.256 0 O-C-N 120.266 -1.521 . . . . 0.0 113.737 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.31 171.58 7.29 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -169.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -135.33 140.25 44.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.621 2.369 . . . . 0.0 111.513 160.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.4 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 27.2 m-85 -104.42 135.43 45.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.415 1.086 . . . . 0.0 110.841 176.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -128.9 127.67 42.26 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.565 1.546 . . . . 0.0 109.409 176.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -105.35 131.24 53.04 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.506 1.122 . . . . 0.0 111.707 -170.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.23 170.16 15.84 Favored 'General case' 0 N--CA 1.44 -0.953 0 C-N-CA 127.917 2.487 . . . . 0.0 105.584 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--N 1.315 -0.934 0 O-C-N 119.533 -1.979 . . . . 0.0 110.56 174.717 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 . . . . . 0 N--CA 1.461 0.083 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.65 135.12 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-O 123.775 1.75 . . . . 0.0 114.77 -169.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.89 130.36 56.8 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.267 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 p -119.31 135.64 54.62 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.06 0.944 . . . . 0.0 111.437 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.4 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 2.3 m -122.15 135.69 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.01 0.924 . . . . 0.0 111.534 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.7 t -104.39 127.1 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 165.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.8 p -148.32 148.68 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.429 1.491 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 t70 60.19 -66.4 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 127.452 2.301 . . . . 0.0 114.258 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -173.01 19.14 0.06 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 128.245 2.831 . . . . 0.0 112.396 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -135.27 167.37 21.14 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.576 2.35 . . . . 0.0 111.66 -168.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -134.95 136.73 42.47 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.627 1.171 . . . . 0.0 112.391 -165.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -135.09 153.92 51.86 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.898 1.679 . . . . 0.0 110.936 -175.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -137.95 135.17 35.77 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.857 1.263 . . . . 0.0 111.889 -178.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.69 106.6 0.63 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 127.368 2.413 . . . . 0.0 111.464 -172.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 p -104.74 114.55 28.83 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.695 1.247 . . . . 0.0 110.72 -177.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.97 143.23 14.65 Favored Glycine 0 CA--C 1.528 0.881 0 CA-C-N 114.412 -1.267 . . . . 0.0 115.562 -170.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -30.05 -53.47 0.16 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 125.573 1.549 . . . . 0.0 114.546 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -137.94 -175.59 4.14 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.81 1.244 . . . . 0.0 110.593 159.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.458 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 95.4 mttt -45.28 -43.66 10.73 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.185 1.394 . . . . 0.0 114.479 177.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.04 -17.17 2.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 115.835 1.791 . . . . 0.0 115.835 177.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.4 tp -115.41 -38.48 3.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.196 1.798 . . . . 0.0 111.254 174.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.47 -54.62 41.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.514 1.126 . . . . 0.0 112.079 173.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.506 ' HB3' HG22 ' A' ' 7' ' ' VAL . 15.3 mmtt -55.19 -44.05 74.96 Favored 'General case' 0 C--O 1.204 -1.32 0 CA-C-O 114.91 -2.472 . . . . 0.0 112.457 162.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -47.69 75.28 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 124.324 3.238 . . . . 0.0 111.474 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -55.39 -62.85 1.4 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.452 1.901 . . . . 0.0 112.728 171.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.1 -55.72 27.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.262 1.425 . . . . 0.0 112.559 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -42.37 -63.92 0.68 Allowed 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 125.592 1.557 . . . . 0.0 114.21 165.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -45.32 75.76 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.832 1.651 . . . . 0.0 111.606 -176.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 m -55.23 -57.73 10.58 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.307 0.643 . . . . 0.0 112.296 175.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.489 ' O ' HG22 ' A' ' 66' ' ' VAL . . . -55.18 -50.87 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.287 1.035 . . . . 0.0 112.503 175.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -60.56 3.12 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.51 1.924 . . . . 0.0 111.164 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.39 -47.59 69.39 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.076 0.398 . . . . 0.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 37.6 m -55.35 -71.19 0.09 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 173.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.489 HG22 ' O ' ' A' ' 62' ' ' ALA . 18.9 m -55.22 -39.93 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.281 0.946 . . . . 0.0 113.43 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -56.32 -46.01 80.07 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.845 -1.159 . . . . 0.0 113.993 170.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -34.97 65.59 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 165.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 20.1 mt . . . . . 0 N--CA 1.483 1.191 0 CA-C-N 119.296 0.953 . . . . 0.0 112.73 170.552 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo . . . . . 0 C--O 1.238 0.478 0 N-CA-C 115.161 1.177 . . . . 0.0 115.161 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.5 t -52.08 -49.69 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.085 0.554 . . . . 0.0 109.616 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -55.56 -51.81 65.85 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 179.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.411 ' H ' HG13 ' A' ' 9' ' ' ILE . 5.0 mt -55.75 -51.19 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.643 1.11 . . . . 0.0 111.884 174.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.86 -51.44 63.61 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.561 1.144 . . . . 0.0 109.876 176.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -55.73 -52.37 64.16 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.127 1.771 . . . . 0.0 112.444 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -55.35 -60.08 3.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.044 2.138 . . . . 0.0 113.58 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.4 mt -55.89 -39.33 71.42 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 30.97 65.6 0.93 Allowed Pre-proline 0 N--CA 1.487 1.404 0 C-N-CA 128.048 2.539 . . . . 0.0 115.495 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -64.59 -34.05 53.59 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.144 2.563 . . . . 0.0 114.435 -167.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.99 25.05 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.693 1.616 . . . . 0.0 113.335 177.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.446 ' CD2' HG22 ' A' ' 39' ' ' VAL . 37.3 mt -58.92 136.27 57.82 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 126.58 1.952 . . . . 0.0 114.866 -165.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -135.08 135.93 41.63 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.629 1.572 . . . . 0.0 110.363 147.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.405 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 20.1 m-85 -104.67 135.28 46.36 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.664 1.228 . . . . 0.0 110.735 -178.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.68 135.59 55.08 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 128.017 2.527 . . . . 0.0 109.101 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -104.79 126.05 51.47 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 122.831 1.3 . . . . 0.0 111.618 -175.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.64 145.84 51.4 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 130.928 3.691 . . . . 0.0 105.631 -176.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.475 0.818 0 O-C-N 119.399 -2.063 . . . . 0.0 110.344 -172.448 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 21.4 m-30 . . . . . 0 N--CA 1.447 -0.602 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -108.58 116.38 51.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 113.493 -1.685 . . . . 0.0 107.406 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 11.8 mmt -104.71 123.8 48.25 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 m -123.13 135.06 54.19 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.405 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 1.8 m -127.91 135.43 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.054 0.942 . . . . 0.0 111.989 -169.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.7 t -104.36 125.26 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 167.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.446 HG22 ' CD2' ' A' ' 17' ' ' LEU . 94.3 t -135.36 -33.86 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -158.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -149.21 26.48 0.87 Allowed 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 122.408 1.099 . . . . 0.0 111.566 -160.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.23 -15.44 8.9 Favored Glycine 0 CA--C 1.538 1.474 0 O-C-N 120.797 -1.189 . . . . 0.0 112.873 -161.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -112.1 168.76 9.35 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.769 2.027 . . . . 0.0 112.252 175.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -133.48 140.23 47.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.585 1.954 . . . . 0.0 111.106 -163.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.97 155.25 51.07 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.945 1.698 . . . . 0.0 110.762 -175.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -132.74 135.08 45.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.285 1.034 . . . . 0.0 110.581 -176.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.01 109.24 0.85 Allowed Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.106 1.336 . . . . 0.0 112.522 -166.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.7 p -104.78 104.63 14.45 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.019 0.909 . . . . 0.0 112.245 -168.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.17 135.93 7.62 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 116.139 1.215 . . . . 0.0 116.139 -176.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -50.46 -23.8 2.69 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -149.34 176.94 10.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.268 1.027 . . . . 0.0 110.831 157.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -47.11 -48.35 22.99 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 125.897 1.679 . . . . 0.0 114.444 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.23 -9.41 0.65 Allowed 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 176.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.8 tp -117.56 -41.73 2.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.808 2.043 . . . . 0.0 110.798 172.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.63 -59.52 4.73 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.647 1.579 . . . . 0.0 113.036 173.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -55.46 -41.58 73.12 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 115.667 -2.111 . . . . 0.0 112.532 164.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -48.97 73.22 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 122.719 2.508 . . . . 0.0 111.19 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -55.32 -58.82 6.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.728 2.011 . . . . 0.0 115.343 163.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.38 -53.71 52.86 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.766 1.166 . . . . 0.0 111.889 -176.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -40.58 -72.84 0.06 Allowed 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 117.525 -1.226 . . . . 0.0 113.634 156.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -45.27 -46.32 12.56 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.175 1.807 . . . . 0.0 113.796 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.4 m -55.27 -63.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.881 1.272 . . . . 0.0 112.895 170.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.34 -59.58 4.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.078 0.951 . . . . 0.0 112.81 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -45.27 -63.34 0.96 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.779 3.231 . . . . 0.0 111.226 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.21 -45.02 75.9 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 175.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 85.5 m -55.33 -68.46 0.19 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.583 0.629 . . . . 0.0 112.359 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.4 m -55.29 -35.32 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.409 1.004 . . . . 0.0 113.125 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -63.73 -40.56 97.03 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.616 -1.303 . . . . 0.0 114.115 175.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -55.41 -39.32 70.07 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 118.926 0.785 . . . . 0.0 112.503 162.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 N--CA 1.483 1.213 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 170.198 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo . . . . . 0 CA--C 1.534 0.523 0 N-CA-C 114.962 1.101 . . . . 0.0 114.962 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.676 HG13 ' HG2' ' A' ' 55' ' ' LYS . 15.2 t -55.44 -52.98 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.666 1.121 . . . . 0.0 109.287 160.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.49 -48.93 73.81 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -176.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.4 pt -60.13 -49.68 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.586 1.085 . . . . 0.0 111.805 169.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.348 0.0 OUTLIER -55.94 -39.37 71.6 Favored 'General case' 0 N--CA 1.461 0.094 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 177.666 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -55.54 -60.2 3.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.619 1.968 . . . . 0.0 109.426 169.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -55.2 -59.2 5.11 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.438 1.495 . . . . 0.0 113.999 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.6 mt -55.73 -45.27 78.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.157 1.783 . . . . 0.0 115.619 171.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 34.83 65.85 1.58 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 127.051 2.14 . . . . 0.0 115.3 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.64 33.91 0.09 OUTLIER 'Trans proline' 0 CA--C 1.557 1.659 1 C-N-CA 125.814 4.342 . . . . 0.0 118.452 -175.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 10.93 85.36 Favored Glycine 0 CA--C 1.539 1.587 0 O-C-N 119.762 -1.836 . . . . 0.0 114.351 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.22 164.0 4.53 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.304 2.241 . . . . 0.0 115.337 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.07 139.49 44.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.79 2.036 . . . . 0.0 111.818 164.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -104.56 135.37 46.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.276 1.03 . . . . 0.0 112.376 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -118.71 135.17 54.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.498 2.319 . . . . 0.0 109.241 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -112.37 129.23 56.38 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 122.315 1.055 . . . . 0.0 112.146 -174.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.74 150.99 51.49 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 129.75 3.22 . . . . 0.0 108.392 -171.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 C--N 1.316 -0.862 0 C-N-CA 126.777 2.031 . . . . 0.0 113.977 -169.746 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.237 0.397 0 N-CA-C 102.654 -3.091 . . . . 0.0 102.654 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 19.1 t -124.1 130.03 73.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 123.197 1.475 . . . . 0.0 109.302 -157.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.5 mmm -118.29 135.34 54.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 113.52 -1.673 . . . . 0.0 108.799 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.5 m -125.19 135.46 52.62 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.508 0.723 . . . . 0.0 110.197 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.6 m -117.86 135.92 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.251 1.021 . . . . 0.0 111.992 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.5 t -104.2 126.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 164.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.7 p -151.66 149.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.693 1.197 . . . . 0.0 110.347 -178.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 55.8 -69.85 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.32 2.248 . . . . 0.0 114.112 -168.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.02 21.88 0.08 OUTLIER Glycine 0 CA--C 1.537 1.451 0 C-N-CA 128.396 2.903 . . . . 0.0 111.794 173.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -128.55 162.43 27.27 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.441 2.296 . . . . 0.0 109.878 -167.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -132.81 133.66 43.66 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.95 1.3 . . . . 0.0 111.626 -173.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -135.11 141.5 46.03 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.608 1.163 . . . . 0.0 110.741 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -118.16 135.04 54.48 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.337 1.855 . . . . 0.0 109.976 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.82 132.7 6.55 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.625 1.107 . . . . 0.0 112.556 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -128.03 104.65 7.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.748 0.785 . . . . 0.0 111.719 -164.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.96 140.56 11.68 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 125.49 1.519 . . . . 0.0 115.161 -163.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -47.37 -27.68 1.74 Allowed 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 116.074 1.879 . . . . 0.0 116.074 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -154.97 174.75 14.72 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 126.639 1.976 . . . . 0.0 109.498 162.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -53.11 -31.78 43.89 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 127.393 2.277 . . . . 0.0 115.982 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -13.9 7.78 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 121.226 1.83 . . . . 0.0 115.127 167.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.35 -50.79 2.72 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.209 2.204 . . . . 0.0 110.264 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -52.56 63.19 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.377 -1.452 . . . . 0.0 112.962 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.676 ' HG2' HG13 ' A' ' 7' ' ' VAL . 4.9 ttmt -55.14 -48.41 73.73 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-O 117.23 -1.367 . . . . 0.0 109.444 169.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.06 72.37 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 120.561 1.528 . . . . 0.0 113.675 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -55.31 -60.95 2.69 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.574 1.149 . . . . 0.0 112.178 172.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -50.87 68.51 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.252 1.021 . . . . 0.0 112.207 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.67 -66.98 0.29 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 126.517 1.927 . . . . 0.0 111.904 171.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -55.45 -38.49 69.12 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.257 0.935 . . . . 0.0 112.942 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 t -55.33 -59.72 4.41 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.872 0.869 . . . . 0.0 113.167 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.14 -56.39 20.43 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.122 1.369 . . . . 0.0 112.672 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.404 ' HG ' ' CZ ' ' A' ' 67' ' ' PHE . 0.6 OUTLIER -43.54 -61.49 1.37 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 111.458 172.622 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.24 -49.25 67.22 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.809 0.731 . . . . 0.0 111.165 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 35.9 m -55.29 -73.38 0.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 173.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.273 34.0 m -55.51 -44.39 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.404 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 7.6 m-30 -56.38 -48.88 75.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 171.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.86 -37.06 68.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 120.212 1.369 . . . . 0.0 113.696 169.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.551 1.015 0 C-N-CA 124.582 1.153 . . . . 0.0 111.655 168.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 C--O 1.236 0.391 0 CA-C-O 118.681 -0.633 . . . . 0.0 113.54 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.573 HG13 ' HG2' ' A' ' 55' ' ' LYS . 78.5 t -53.87 -51.76 41.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.03 -49.13 72.33 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -177.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.64 -58.18 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.218 1.007 . . . . 0.0 111.371 174.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.439 ' HB2' HD13 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -55.06 -46.36 75.37 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.453 1.101 . . . . 0.0 111.635 179.793 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -55.56 -57.29 12.54 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.271 1.828 . . . . 0.0 112.427 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -55.85 -53.16 60.08 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.708 1.603 . . . . 0.0 113.174 175.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.46 -34.97 64.98 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.069 1.348 . . . . 0.0 113.488 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 35.8 54.11 2.22 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 127.161 2.184 . . . . 0.0 115.245 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -73.21 58.53 3.6 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 124.71 3.607 . . . . 0.0 115.227 -167.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.42 17.89 78.0 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.513 1.53 . . . . 0.0 114.84 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -81.62 174.1 11.72 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -172.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -134.97 143.06 46.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 127.127 2.171 . . . . 0.0 110.309 157.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -104.32 129.64 52.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 124.664 1.228 . . . . 0.0 109.584 172.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.72 135.18 51.71 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 127.69 2.396 . . . . 0.0 108.482 177.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -109.77 125.63 52.9 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 123.144 1.45 . . . . 0.0 111.701 -176.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 mp -135.09 157.09 47.82 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 131.319 3.847 . . . . 0.0 105.826 -173.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 C--N 1.322 -0.611 0 O-C-N 119.317 -2.114 . . . . 0.0 110.144 169.648 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 . . . . . 0 N--CA 1.445 -0.684 0 N-CA-C 104.604 -2.369 . . . . 0.0 104.604 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -118.65 117.74 55.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 123.046 1.403 . . . . 0.0 110.561 -168.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.2 mmm -105.33 126.06 51.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.733 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.7 m -116.71 135.5 53.72 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 123.652 0.781 . . . . 0.0 110.125 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 m -119.48 135.91 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.954 0.902 . . . . 0.0 111.702 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 87.8 t -104.11 127.79 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 160.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.1 p -148.85 146.93 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.825 1.65 . . . . 0.0 109.321 -174.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.6 t70 59.07 -67.22 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.944 2.098 . . . . 0.0 114.668 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 19.47 0.07 OUTLIER Glycine 0 CA--C 1.541 1.719 0 C-N-CA 128.528 2.966 . . . . 0.0 112.798 169.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -135.12 165.04 26.3 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.721 2.408 . . . . 0.0 111.667 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -133.92 137.39 44.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.538 1.135 . . . . 0.0 112.779 -167.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -135.13 157.48 46.82 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.428 1.491 . . . . 0.0 111.812 -175.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -132.83 133.83 43.87 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.557 1.943 . . . . 0.0 109.268 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -131.4 113.54 1.38 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 125.036 1.303 . . . . 0.0 112.089 -175.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.5 p -104.99 108.96 20.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.289 1.035 . . . . 0.0 112.122 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.65 143.49 15.05 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.927 1.727 . . . . 0.0 114.466 -173.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -17.85 1.47 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 177.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -161.5 179.51 8.17 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.499 1.92 . . . . 0.0 110.308 153.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -45.45 -40.45 8.3 Favored 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.357 1.863 . . . . 0.0 115.766 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.01 -16.96 5.62 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 174.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -118.33 -44.24 2.68 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.886 2.074 . . . . 0.0 111.378 176.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.46 -53.26 58.53 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.582 -1.324 . . . . 0.0 112.77 175.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.573 ' HG2' HG13 ' A' ' 7' ' ' VAL . 8.2 ttmt -55.24 -46.25 76.04 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-O 116.53 -1.7 . . . . 0.0 110.967 166.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.05 75.06 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 121.972 2.169 . . . . 0.0 112.578 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -55.48 -60.25 3.69 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.522 1.929 . . . . 0.0 112.163 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.24 -50.66 68.89 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.428 1.091 . . . . 0.0 112.322 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.5 -59.64 3.57 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.239 1.816 . . . . 0.0 111.618 170.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -48.35 72.77 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 120.104 1.32 . . . . 0.0 110.691 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -55.36 -60.33 3.55 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 173.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.37 -61.55 2.26 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 126.493 1.917 . . . . 0.0 112.307 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.439 HD13 ' HB2' ' A' ' 10' ' ' LEU . 11.7 tp -53.29 -53.26 53.46 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.647 2.379 . . . . 0.0 111.922 -177.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.33 74.42 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.052 0.842 . . . . 0.0 112.802 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 95.6 m -55.28 -62.55 1.6 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.6 0.76 . . . . 0.0 112.984 175.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 m -55.58 -46.29 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.95 -47.45 77.58 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.83 -38.93 70.69 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.719 1.208 . . . . 0.0 114.248 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.551 0.995 0 C-N-CA 124.993 1.317 . . . . 0.0 111.803 167.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo . . . . . 0 CA--C 1.532 0.415 0 N-CA-C 115.12 1.161 . . . . 0.0 115.12 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.502 HG13 ' HG2' ' A' ' 55' ' ' LYS . 42.6 t -55.18 -44.77 76.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 CA-C-N 118.85 0.75 . . . . 0.0 110.548 168.372 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.32 -42.64 74.02 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.854 -1.154 . . . . 0.0 113.019 177.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.6 mt -60.22 -57.39 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.648 1.179 . . . . 0.0 110.684 173.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.315 0.0 OUTLIER -55.84 -38.9 70.68 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 115.645 1.721 . . . . 0.0 115.645 176.291 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -56.13 -52.86 62.83 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 124.848 1.259 . . . . 0.0 111.559 171.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.26 -65.62 0.55 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.705 1.602 . . . . 0.0 113.175 173.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.8 mt -55.57 -43.41 75.88 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.636 1.574 . . . . 0.0 115.234 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.263 7.7 ptm85 30.24 66.89 0.79 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 128.299 2.64 . . . . 0.0 115.246 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -61.02 20.17 0.04 OUTLIER 'Trans proline' 0 CA--C 1.552 1.392 1 C-N-CA 125.777 4.318 . . . . 0.0 118.348 -175.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.19 30.36 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.123 1.345 . . . . 0.0 113.698 -175.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 pp -88.7 159.67 17.71 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -176.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.46 138.42 43.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.212 1.805 . . . . 0.0 112.493 -179.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -104.67 135.13 46.64 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.431 1.11 . . . . 0.0 112.85 -171.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -105.28 135.32 46.86 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.018 2.527 . . . . 0.0 108.843 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -108.35 121.11 44.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.114 0.959 . . . . 0.0 110.958 175.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.6 155.97 43.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 129.453 3.101 . . . . 0.0 107.123 -175.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.7 t . . . . . 0 C--N 1.321 -0.67 0 O-C-N 120.451 -1.405 . . . . 0.0 110.857 160.121 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 . . . . . 0 CA--C 1.519 -0.244 0 N-CA-C 105.915 -1.884 . . . . 0.0 105.915 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.3 t -112.84 117.5 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 122.038 0.923 . . . . 0.0 109.208 -169.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 78.9 mmm -104.77 135.04 46.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 173.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.2 m -132.81 135.47 45.69 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 122.47 0.308 . . . . 0.0 111.055 -176.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.11 135.51 60.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.303 1.041 . . . . 0.0 112.191 -173.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.6 t -104.47 120.11 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 167.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 78.2 t -125.04 -45.44 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -157.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -148.27 29.98 0.86 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 122.669 1.223 . . . . 0.0 111.066 -162.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.94 -12.71 22.47 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 120.532 -1.355 . . . . 0.0 112.963 -162.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -109.96 161.78 15.16 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 126.688 1.995 . . . . 0.0 111.735 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -134.85 137.96 43.75 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.039 1.736 . . . . 0.0 111.389 -162.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -134.97 149.94 50.29 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.373 1.469 . . . . 0.0 111.088 -175.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -132.9 135.04 45.34 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.274 1.43 . . . . 0.0 110.399 -174.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.83 117.41 1.75 Allowed Glycine 0 CA--C 1.523 0.557 0 C-N-CA 125.238 1.399 . . . . 0.0 112.707 -167.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 p -106.64 104.73 14.49 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.736 1.214 . . . . 0.0 112.26 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 147.73 19.33 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.633 1.587 . . . . 0.0 114.795 -173.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -44.24 -39.32 4.37 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -155.2 177.42 11.36 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.777 1.631 . . . . 0.0 110.333 165.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -45.23 -41.39 8.37 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 127.422 2.289 . . . . 0.0 116.159 -174.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 -13.87 1.74 Allowed 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.5 tp -125.98 -42.71 1.87 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.439 2.295 . . . . 0.0 111.505 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.72 40.49 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.443 -1.411 . . . . 0.0 112.333 172.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.502 ' HG2' HG13 ' A' ' 7' ' ' VAL . 11.2 ttmt -55.41 -39.77 70.62 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 117.419 -1.277 . . . . 0.0 111.932 168.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.39 -54.83 38.82 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.576 1.535 . . . . 0.0 111.667 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -54.99 -52.79 62.02 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.638 1.975 . . . . 0.0 113.661 171.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -52.62 63.11 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.622 0.769 . . . . 0.0 112.126 177.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.18 -53.65 47.51 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 125.854 1.662 . . . . 0.0 112.202 171.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -52.49 -50.4 62.81 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.634 1.574 . . . . 0.0 111.876 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.8 t -55.3 -56.45 19.91 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 113.034 171.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -61.45 2.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.771 1.229 . . . . 0.0 112.718 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.44 ' HG ' ' CE2' ' A' ' 67' ' ' PHE . 0.4 OUTLIER -46.23 -57.78 4.25 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 128.566 2.746 . . . . 0.0 111.5 176.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.89 -49.88 70.14 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.528 0.604 . . . . 0.0 111.103 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 50.2 m -55.24 -73.97 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 173.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.288 18.3 m -55.72 -44.62 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -175.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.44 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 6.6 m-30 -60.06 -44.54 94.65 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.652 -1.28 . . . . 0.0 114.149 172.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.83 -37.6 68.9 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.384 1.447 . . . . 0.0 114.439 168.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.548 0.902 0 C-N-CA 124.851 1.26 . . . . 0.0 111.594 167.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo . . . . . 0 N--CA 1.461 -0.433 0 N-CA-C 114.942 1.093 . . . . 0.0 114.942 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.535 HG22 ' HB3' ' A' ' 55' ' ' LYS . 90.0 t -55.04 -52.9 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 173.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -55.45 -54.77 39.68 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 127.154 2.181 . . . . 0.0 115.558 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.276 1.7 pt -59.95 -50.38 80.34 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-O 118.115 -0.945 . . . . 0.0 113.085 172.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.307 0.0 OUTLIER -55.52 -46.24 77.05 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.462 1.483 . . . . 0.0 113.521 178.692 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -46.96 -63.07 1.13 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.247 2.219 . . . . 0.0 111.809 168.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -56.28 -47.02 79.45 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 176.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.5 mt -55.67 -29.16 58.86 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.909 1.283 . . . . 0.0 114.342 171.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 35.36 60.41 2.62 Favored Pre-proline 0 N--CA 1.486 1.362 0 C-N-CA 126.782 2.033 . . . . 0.0 116.238 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -59.42 21.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.56 1.786 0 C-N-CA 125.244 3.963 . . . . 0.0 119.58 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.23 24.72 76.69 Favored Glycine 0 CA--C 1.536 1.391 0 O-C-N 119.856 -1.777 . . . . 0.0 112.775 -167.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.42 171.96 7.89 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.918 2.087 . . . . 0.0 115.032 -172.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.35 135.25 40.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.091 1.357 . . . . 0.0 111.942 158.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -104.68 135.63 45.71 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.235 1.414 . . . . 0.0 110.549 173.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -130.31 135.16 47.78 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.418 1.487 . . . . 0.0 109.906 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -107.98 128.56 54.76 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.578 1.18 . . . . 0.0 112.214 -168.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.8 151.49 52.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 129.839 3.256 . . . . 0.0 106.702 -172.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p . . . . . 0 C--N 1.322 -0.63 0 O-C-N 119.933 -1.73 . . . . 0.0 110.127 161.2 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 . . . . . 0 CA--C 1.512 -0.517 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.4 t -109.89 124.24 66.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.021 -1.445 . . . . 0.0 109.89 -169.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 63.1 mmm -104.86 124.36 49.31 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -111.38 134.02 53.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.513 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.64 135.58 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.469 0.708 . . . . 0.0 111.571 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -104.47 119.79 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 166.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.7 m -133.65 -3.03 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 -160.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -155.43 -20.11 0.11 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 -174.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.31 -18.33 28.06 Favored Glycine 0 CA--C 1.538 1.48 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -142.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -105.0 162.17 13.58 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.701 1.6 . . . . 0.0 110.841 170.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -133.68 140.05 46.81 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.254 1.822 . . . . 0.0 110.925 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.03 159.56 41.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.103 1.361 . . . . 0.0 111.532 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -135.6 134.66 39.54 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.361 1.864 . . . . 0.0 109.411 176.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.1 120.71 2.83 Favored Glycine 0 CA--C 1.523 0.551 0 C-N-CA 125.158 1.361 . . . . 0.0 111.338 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.4 p -105.01 110.47 22.88 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.648 1.179 . . . . 0.0 111.708 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.47 155.75 22.35 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.867 1.698 . . . . 0.0 114.465 -168.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -55.06 -38.74 68.41 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.801 -0.823 . . . . 0.0 113.148 174.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -151.17 -177.44 6.04 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.794 1.638 . . . . 0.0 109.193 159.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.5 mtmm -44.22 -35.04 2.08 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 127.683 2.393 . . . . 0.0 115.082 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.2 pttt -46.34 -29.91 1.87 Allowed 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.5 tp -121.3 -40.7 2.56 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.193 2.197 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.55 -52.03 65.08 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.904 1.282 . . . . 0.0 112.664 173.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.535 ' HB3' HG22 ' A' ' 7' ' ' VAL . 5.4 ttmt -55.38 -47.93 75.07 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 117.398 -1.286 . . . . 0.0 110.866 166.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.8 73.7 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 120.471 1.487 . . . . 0.0 112.686 -176.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.4 mmm-85 -55.03 -59.77 4.3 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.885 2.874 . . . . 0.0 113.305 169.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -49.42 72.57 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.594 0.712 . . . . 0.0 112.506 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.98 -51.49 66.04 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 126.646 1.978 . . . . 0.0 112.111 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -54.94 -47.6 74.25 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.409 1.484 . . . . 0.0 111.904 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.33 -54.97 36.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.577 1.151 . . . . 0.0 112.774 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.1 -57.94 9.71 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.98 -55.06 13.05 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 128.371 2.668 . . . . 0.0 111.61 176.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.11 68.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.504 0.593 . . . . 0.0 110.92 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 27.1 m -55.47 -74.67 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 172.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.1 m -55.56 -37.28 45.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.26 4.8 m-30 -68.47 -33.61 74.48 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 171.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -55.51 -35.26 65.41 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.152 -1.592 . . . . 0.0 113.156 159.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.5 mt . . . . . 0 N--CA 1.479 0.976 0 CA-C-O 118.248 -0.882 . . . . 0.0 112.429 169.898 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 N--CA 1.46 -0.499 0 CA-C-O 118.148 -0.855 . . . . 0.0 113.786 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.602 HG13 ' HG2' ' A' ' 55' ' ' LYS . 97.0 t -54.99 -53.24 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 171.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.55 -55.47 31.59 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.271 7.3 pt -58.42 -47.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 120.735 1.607 . . . . 0.0 114.399 174.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 7' ' ' VAL 0.275 0.0 OUTLIER -55.58 -46.65 77.22 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 174.676 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -55.2 -54.69 40.16 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.464 1.905 . . . . 0.0 112.324 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -55.4 -61.1 2.56 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.548 1.939 . . . . 0.0 113.259 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.432 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 8.3 mt -55.62 -34.91 65.32 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 175.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 36.76 58.57 3.64 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 127.127 2.171 . . . . 0.0 114.598 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.62 65.61 1.2 Allowed 'Trans proline' 0 CA--C 1.551 1.366 0 C-N-CA 124.52 3.48 . . . . 0.0 115.253 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.58 29.48 75.26 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.787 1.661 . . . . 0.0 114.835 172.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.3 pp -105.21 166.27 10.52 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 -163.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.31 145.63 47.67 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.733 2.013 . . . . 0.0 111.886 166.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -104.56 128.92 52.66 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.686 0.795 . . . . 0.0 110.471 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -104.89 134.34 48.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.227 1.811 . . . . 0.0 109.258 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.445 ' CE1' ' HE3' ' A' ' 51' ' ' LYS . 62.9 t80 -113.17 126.11 55.08 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.784 1.278 . . . . 0.0 110.969 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.93 154.92 47.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 130.065 3.346 . . . . 0.0 106.024 -173.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.5 t . . . . . 0 C--N 1.321 -0.641 0 O-C-N 119.577 -1.952 . . . . 0.0 110.133 164.578 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 . . . . . 0 N--CA 1.442 -0.827 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.4 t -112.99 127.21 70.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 123.287 1.518 . . . . 0.0 110.22 -170.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.75 135.12 46.72 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.961 -1.472 . . . . 0.0 107.571 171.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -122.67 135.31 54.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 122.739 0.416 . . . . 0.0 110.582 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.88 135.78 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.555 -0.716 . . . . 0.0 111.529 172.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.8 t -101.09 122.07 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 160.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.97 142.75 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 127.015 2.126 . . . . 0.0 108.881 -167.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.8 t70 58.32 -67.04 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.428 1.891 . . . . 0.0 114.172 -174.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -170.11 17.97 0.07 OUTLIER Glycine 0 CA--C 1.541 1.706 0 C-N-CA 128.539 2.971 . . . . 0.0 112.827 169.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -134.96 165.81 24.48 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.767 2.427 . . . . 0.0 111.73 -168.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -134.86 128.61 32.98 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.467 1.107 . . . . 0.0 112.222 -162.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.37 136.59 43.48 Favored 'General case' 0 C--O 1.206 -1.218 0 C-N-CA 124.923 1.289 . . . . 0.0 111.956 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -104.44 134.51 47.52 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 126.719 2.008 . . . . 0.0 109.85 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.69 112.67 1.16 Allowed Glycine 0 CA--C 1.52 0.367 0 C-N-CA 124.796 1.189 . . . . 0.0 112.202 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 p -104.8 117.18 33.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.671 0.788 . . . . 0.0 111.867 -172.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.52 146.49 18.5 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 125.158 1.361 . . . . 0.0 115.489 -166.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.42 -36.04 6.13 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 168.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -157.52 178.18 10.58 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.792 2.037 . . . . 0.0 109.066 162.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.445 ' HE3' ' CE1' ' A' ' 21' ' ' PHE . 82.0 mttt -46.44 -36.4 6.54 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 126.676 1.99 . . . . 0.0 115.162 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -16.14 2.42 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.3 tp -123.31 -43.29 2.2 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.7 2.0 . . . . 0.0 110.724 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.5 -52.43 63.7 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.554 -1.341 . . . . 0.0 112.279 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.602 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.4 ttmt -55.41 -47.28 76.16 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 117.529 -1.224 . . . . 0.0 110.677 169.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.49 -47.68 75.8 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 120.273 1.397 . . . . 0.0 112.615 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -55.48 -59.66 4.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.738 2.015 . . . . 0.0 112.03 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.35 -49.84 71.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.39 1.076 . . . . 0.0 112.092 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.23 -58.62 6.43 Favored 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 126.344 1.858 . . . . 0.0 112.406 173.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -55.31 -44.86 76.17 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.442 1.474 . . . . 0.0 111.689 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.6 m -55.26 -55.31 32.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.87 0.868 . . . . 0.0 112.505 173.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.24 -56.24 22.26 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.739 1.215 . . . . 0.0 112.329 174.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.41 -56.87 6.08 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 128.047 2.539 . . . . 0.0 111.183 176.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.15 -52.69 60.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.298 0.499 . . . . 0.0 110.762 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -71.2 0.09 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 175.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.289 24.7 m -55.26 -51.32 56.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 O-C-N 121.058 -1.026 . . . . 0.0 112.587 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.432 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 5.9 m-30 -55.79 -33.93 64.84 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 121.366 1.894 . . . . 0.0 114.777 174.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -55.72 -38.12 69.32 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 162.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.9 mt . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 162.906 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo . . . . . 0 C--O 1.237 0.432 0 N-CA-C 113.825 0.663 . . . . 0.0 113.825 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.7 t -54.24 -50.93 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -55.71 28.44 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.0 pt -55.58 -49.2 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.821 1.191 . . . . 0.0 113.671 172.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.445 ' HA ' HD13 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -54.56 -51.26 65.81 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.51 1.05 . . . . 0.0 112.047 177.131 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -55.63 -54.01 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.207 1.803 . . . . 0.0 112.72 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -59.99 -45.03 94.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -39.56 71.33 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.963 1.305 . . . . 0.0 113.359 171.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 30.85 61.11 1.05 Allowed Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 127.826 2.45 . . . . 0.0 116.241 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -53.63 -38.83 84.49 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.513 2.142 . . . . 0.0 114.918 -174.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.36 33.92 0.12 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.411 1.481 . . . . 0.0 112.258 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.446 HD13 ' CE1' ' A' ' 19' ' ' TYR . 1.4 pp -77.61 151.58 34.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 117.046 2.239 . . . . 0.0 117.046 -154.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 135.8 40.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.203 2.201 . . . . 0.0 112.606 157.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.635 ' CD2' ' HE3' ' A' ' 55' ' ' LYS . 65.3 m-85 -104.86 135.58 45.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.822 1.249 . . . . 0.0 112.913 -177.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -108.12 135.73 48.98 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 128.664 2.785 . . . . 0.0 110.91 173.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -104.97 126.57 52.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.558 1.143 . . . . 0.0 111.452 171.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.7 mp -135.05 144.28 47.18 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 129.475 3.11 . . . . 0.0 106.903 -173.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p . . . . . 0 N--CA 1.477 0.892 0 O-C-N 119.31 -2.119 . . . . 0.0 111.293 149.142 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 . . . . . 0 N--CA 1.45 -0.444 0 N-CA-C 104.146 -2.539 . . . . 0.0 104.146 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.7 t -112.98 116.55 52.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 123.103 1.43 . . . . 0.0 109.063 -161.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.8 mmt -105.14 122.94 46.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.478 -1.237 . . . . 0.0 107.859 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -128.5 135.24 49.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -172.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.2 t -135.03 135.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 120.839 -1.163 . . . . 0.0 109.724 -163.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.7 t -104.1 104.73 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 103.061 -2.941 . . . . 0.0 103.061 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.8 p -100.84 -12.39 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -152.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -167.72 -37.38 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.258 2.223 . . . . 0.0 111.643 -158.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 150.78 -25.06 1.04 Allowed Glycine 0 CA--C 1.538 1.515 0 C-N-CA 125.872 1.701 . . . . 0.0 110.72 -161.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.85 163.0 13.07 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 125.26 1.424 . . . . 0.0 110.372 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.81 138.67 53.85 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.71 1.604 . . . . 0.0 112.079 -168.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -135.11 157.67 46.34 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.166 1.786 . . . . 0.0 111.844 -172.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -139.54 133.48 30.86 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.442 1.497 . . . . 0.0 110.384 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.96 119.58 2.17 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.471 1.51 . . . . 0.0 112.305 -173.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.2 p -105.24 104.96 14.79 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.409 1.084 . . . . 0.0 112.413 -171.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.87 138.03 9.6 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 125.115 1.34 . . . . 0.0 115.766 -176.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -57.66 -12.92 3.24 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -155.5 177.85 10.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.527 1.131 . . . . 0.0 111.231 155.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -49.75 -51.76 36.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 124.834 1.253 . . . . 0.0 113.818 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -6.76 0.44 Allowed 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 177.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.3 tp -115.26 -44.74 2.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.712 1.605 . . . . 0.0 110.308 171.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.56 -59.2 5.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.876 1.271 . . . . 0.0 113.086 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.635 ' HE3' ' CD2' ' A' ' 19' ' ' TYR . 18.8 mmtm -55.45 -37.81 68.21 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 115.288 -2.291 . . . . 0.0 112.581 164.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.72 -54.67 41.43 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 123.355 2.798 . . . . 0.0 111.492 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.33 -55.43 31.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 129.089 2.956 . . . . 0.0 113.749 170.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.41 -56.62 17.99 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 111.462 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . 0.42 ' CB ' ' HG ' ' A' ' 10' ' ' LEU . . . -44.97 -62.04 1.39 Allowed 'General case' 0 C--O 1.215 -0.749 0 C-N-CA 124.084 0.953 . . . . 0.0 113.161 166.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -47.53 -53.19 15.07 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.413 1.485 . . . . 0.0 112.015 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 25.1 p -55.4 -57.57 11.33 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 173.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.32 -64.25 0.9 Allowed 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 126.635 1.974 . . . . 0.0 112.014 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.445 HD13 ' HA ' ' A' ' 10' ' ' LEU . 11.9 tp -50.43 -54.45 21.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.677 2.791 . . . . 0.0 111.988 -179.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.17 -49.39 71.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.504 0.593 . . . . 0.0 112.388 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.3 m -55.43 -60.99 2.64 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 175.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 4.8 m -55.26 -47.56 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.275 0.943 . . . . 0.0 112.707 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.85 -47.05 77.97 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -55.49 -39.72 70.79 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.732 1.213 . . . . 0.0 112.541 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.55 0.949 0 C-N-CA 124.813 1.245 . . . . 0.0 110.374 166.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo . . . . . 0 N--CA 1.488 1.175 0 N-CA-C 112.561 0.177 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.2 m -158.33 156.41 30.53 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.747 1.619 . . . . 0.0 110.708 172.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 75.97 -45.71 1.99 Allowed Glycine 0 CA--C 1.538 1.473 0 C-N-CA 125.685 1.612 . . . . 0.0 114.554 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.46 170.92 14.82 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.845 2.058 . . . . 0.0 110.994 177.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -54.82 138.67 63.07 Favored Pre-proline 0 CA--C 1.552 1.04 0 C-N-CA 123.214 0.605 . . . . 0.0 109.858 158.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -63.66 -29.7 69.61 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 122.896 2.397 . . . . 0.0 114.862 -172.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.559 HG13 ' HG2' ' A' ' 55' ' ' LYS . 71.8 t -55.09 -51.53 53.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 174.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.33 -44.26 75.69 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.072 1.349 . . . . 0.0 114.386 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 2.8 mt -58.23 -57.76 9.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 123.829 0.851 . . . . 0.0 112.148 171.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -55.32 -38.54 68.84 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.601 0.715 . . . . 0.0 112.304 178.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -55.08 -61.31 2.4 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.152 1.781 . . . . 0.0 111.928 168.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -55.57 -56.47 19.99 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.05 -1.031 . . . . 0.0 113.179 179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 67.6 mt -55.93 -29.16 59.66 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 117.504 2.409 . . . . 0.0 117.504 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.325 0.0 OUTLIER -9.21 75.92 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.757 0 N-CA-C 118.064 2.616 . . . . 0.0 118.064 -167.695 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -58.04 -34.55 98.55 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 122.022 1.815 . . . . 0.0 116.196 -165.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 177.55 30.12 0.04 OUTLIER Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.228 1.394 . . . . 0.0 112.123 172.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -96.51 164.14 12.74 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -161.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.12 141.28 45.96 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.634 1.574 . . . . 0.0 112.535 173.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -104.55 135.23 46.34 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.623 1.169 . . . . 0.0 111.764 -177.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -104.82 135.25 46.53 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.106 1.362 . . . . 0.0 109.685 164.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -104.43 119.94 40.1 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 122.103 0.954 . . . . 0.0 109.016 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.0 mp -123.17 136.02 54.57 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 128.846 2.859 . . . . 0.0 106.57 -176.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.0 t -85.41 159.94 19.87 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 119.463 -2.023 . . . . 0.0 109.756 154.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.316 26.4 mm-40 100.04 80.34 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 126.072 1.749 . . . . 0.0 114.962 158.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.7 t -121.12 5.86 10.31 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.684 148.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 50.62 -159.11 1.74 Allowed Glycine 0 CA--C 1.539 1.554 0 C-N-CA 126.317 1.913 . . . . 0.0 114.812 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.82 163.34 4.57 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 128.739 2.815 . . . . 0.0 113.545 -10.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.3 m -70.05 18.92 0.05 OUTLIER 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 115.585 1.698 . . . . 0.0 115.585 -175.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -130.34 -38.4 1.37 Allowed 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.475 1.11 . . . . 0.0 113.95 -163.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -131.18 -6.2 3.86 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.844 1.258 . . . . 0.0 113.274 169.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 47.7 tptt 84.73 149.14 0.07 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 128.245 2.618 . . . . 0.0 114.306 150.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.6 m -129.6 135.2 48.27 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 123.486 1.612 . . . . 0.0 112.247 161.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -104.63 135.63 45.68 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 129.542 3.137 . . . . 0.0 104.12 173.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 53.3 t -115.92 130.09 71.19 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.092 0 CA-C-O 122.711 1.243 . . . . 0.0 109.875 -167.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 5.4 mmt -115.09 123.87 50.11 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 123.532 0.733 . . . . 0.0 110.333 177.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.88 136.58 44.11 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 123.931 0.892 . . . . 0.0 110.443 172.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.4 m -121.98 135.87 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.114 0.566 . . . . 0.0 112.397 167.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 47.9 t -104.47 128.54 57.94 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 161.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.436 HG13 ' H ' ' A' ' 40' ' ' ASP 0.305 7.7 p -126.74 -110.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 124.626 1.17 . . . . 0.0 111.508 -179.373 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.436 ' H ' HG13 ' A' ' 39' ' ' VAL . 25.4 t0 -81.14 45.22 0.82 Allowed 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 121.189 1.813 . . . . 0.0 114.025 -168.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.4 13.99 80.89 Favored Glycine 0 CA--C 1.535 1.298 0 O-C-N 120.935 -1.103 . . . . 0.0 112.07 -166.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 66.2 mm-40 -119.09 153.1 35.33 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 127.013 2.125 . . . . 0.0 109.981 -171.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -134.01 134.63 42.67 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.489 1.116 . . . . 0.0 111.712 -174.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -135.24 154.65 51.5 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.062 1.345 . . . . 0.0 111.287 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -134.74 134.81 41.4 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.133 2.173 . . . . 0.0 108.573 175.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.04 122.19 2.78 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 124.828 1.204 . . . . 0.0 111.901 -176.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.6 p -105.68 114.55 28.77 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.554 1.142 . . . . 0.0 111.511 -173.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.57 145.28 17.3 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.686 1.136 . . . . 0.0 115.818 -175.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.47 -24.13 0.47 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 116.174 1.916 . . . . 0.0 116.174 172.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -158.25 177.67 11.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.91 1.684 . . . . 0.0 109.699 156.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.406 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 28.4 mtmm -49.28 -36.2 19.99 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 126.545 1.938 . . . . 0.0 115.149 177.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.39 -13.08 1.26 Allowed 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 170.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.6 tp -125.53 -42.71 1.93 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.884 2.074 . . . . 0.0 110.862 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.406 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.45 -54.62 41.53 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.584 -1.322 . . . . 0.0 111.61 173.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.559 ' HG2' HG13 ' A' ' 7' ' ' VAL . 9.4 ttmt -55.48 -42.5 74.45 Favored 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.071 -1.442 . . . . 0.0 111.676 167.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.34 -51.42 66.81 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 121.238 1.836 . . . . 0.0 112.838 178.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -55.25 -56.33 21.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 129.495 3.118 . . . . 0.0 112.493 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.22 -53.54 54.79 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.836 1.254 . . . . 0.0 112.577 175.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.48 -56.46 9.69 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 126.409 1.884 . . . . 0.0 112.037 170.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -53.81 -48.0 70.3 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.697 1.599 . . . . 0.0 112.452 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.1 m -55.29 -57.92 9.84 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.581 1.152 . . . . 0.0 112.743 172.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -58.22 8.58 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.63 1.172 . . . . 0.0 111.762 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.417 ' HG ' ' CE2' ' A' ' 67' ' ' PHE . 0.5 OUTLIER -40.23 -59.43 1.28 Allowed 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 128.416 2.687 . . . . 0.0 110.86 173.529 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.81 -56.66 15.52 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.174 0.443 . . . . 0.0 111.489 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 93.0 m -55.25 -70.35 0.11 Allowed 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 176.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.259 12.0 m -55.46 -40.85 60.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -175.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.417 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 6.8 m-30 -60.46 -40.24 90.47 Favored 'General case' 0 N--CA 1.468 0.447 0 O-C-N 120.166 -1.584 . . . . 0.0 114.212 170.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.49 -35.14 65.23 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 120.262 1.392 . . . . 0.0 114.456 162.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt -71.96 -16.47 62.09 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 118.829 0.741 . . . . 0.0 112.999 169.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.1 m-70 66.42 41.62 3.2 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 127.802 2.441 . . . . 0.0 111.761 -174.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--O 1.253 1.241 0 C-N-CA 126.908 2.083 . . . . 0.0 111.297 -168.014 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 CA--C 1.538 0.716 0 N-CA-C 112.649 0.211 . . . . 0.0 112.649 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 m -67.99 29.97 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 127.996 2.518 . . . . 0.0 116.806 -168.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 64.65 20.49 66.12 Favored Glycine 0 CA--C 1.538 1.516 0 O-C-N 120.38 -1.45 . . . . 0.0 112.918 -165.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.0 tttt -59.38 133.74 56.37 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 127.172 2.189 . . . . 0.0 112.608 -168.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -133.71 175.4 3.71 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 126.783 2.033 . . . . 0.0 109.242 -179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.5 -38.66 32.01 Favored 'Trans proline' 0 C--N 1.347 0.494 0 CA-C-N 121.539 1.586 . . . . 0.0 113.933 -173.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.501 HG13 ' HG2' ' A' ' 55' ' ' LYS . 86.4 t -55.18 -49.34 72.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 173.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.23 -46.85 75.98 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 11.0 mt -55.85 -56.17 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 CA-C-N 119.611 1.096 . . . . 0.0 111.212 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.507 HD21 ' HE2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -54.83 -43.73 73.26 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.127 0.971 . . . . 0.0 112.719 -179.672 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -56.22 -58.02 9.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 127.006 2.122 . . . . 0.0 112.501 172.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -55.21 -55.02 36.04 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.81 2.044 . . . . 0.0 112.359 177.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mt -55.97 -38.15 70.01 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.897 1.814 . . . . 0.0 115.897 171.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.288 0.0 OUTLIER 24.11 65.39 0.4 Allowed Pre-proline 0 N--CA 1.488 1.459 0 C-N-CA 127.399 2.28 . . . . 0.0 115.156 -168.724 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.53 55.93 3.83 Favored 'Trans proline' 0 CA--C 1.549 1.249 0 C-N-CA 124.811 3.674 . . . . 0.0 113.566 -173.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 63.19 24.27 67.05 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 125.8 1.666 . . . . 0.0 115.431 173.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.486 HD21 ' CD2' ' A' ' 10' ' ' LEU . 3.1 pp -90.62 173.3 8.12 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 118.494 1.147 . . . . 0.0 112.998 -172.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.6 ptmm? -133.26 134.93 44.58 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 123.823 0.849 . . . . 0.0 111.19 169.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.507 ' HE2' HD21 ' A' ' 10' ' ' LEU . 10.5 m-85 -104.49 135.3 46.17 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 125.59 1.556 . . . . 0.0 109.888 175.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -123.3 135.53 54.26 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 126.822 2.049 . . . . 0.0 109.793 179.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 t80 -104.72 130.42 52.79 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 122.754 1.264 . . . . 0.0 111.906 -168.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.2 mp -135.08 157.35 47.16 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 129.617 3.167 . . . . 0.0 108.386 -171.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 85.4 p -126.07 140.21 52.77 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 125.489 1.516 . . . . 0.0 111.656 172.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 85.54 78.04 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 127.738 2.415 . . . . 0.0 115.44 165.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.424 ' H ' ' HB3' ' A' ' 32' ' ' SER . 10.0 t -63.78 -28.28 69.76 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 117.218 2.303 . . . . 0.0 117.218 166.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -91.01 2.85 80.12 Favored Glycine 0 N--CA 1.472 1.059 1 C-N-CA 131.907 4.575 . . . . 0.0 115.501 -7.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 48.62 50.23 17.41 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-N 119.025 1.413 . . . . 0.0 110.296 -174.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.6 m -62.33 10.12 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 129.129 2.972 . . . . 0.0 117.671 -151.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -58.58 -32.28 68.81 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 121.314 -0.866 . . . . 0.0 111.175 157.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.5 -59.29 0.07 Allowed 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 163.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.2 tppm? -165.8 145.25 6.31 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.203 1.001 . . . . 0.0 112.219 -166.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.424 ' HB3' ' H ' ' A' ' 25' ' ' SER . 0.4 OUTLIER -135.26 137.79 42.88 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 126.514 1.926 . . . . 0.0 110.766 174.777 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -104.35 135.45 45.77 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 104.038 -2.578 . . . . 0.0 104.038 166.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 56.6 t -115.17 130.32 69.91 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-O 122.153 0.978 . . . . 0.0 108.976 -168.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 52.7 mmm -117.03 119.45 35.32 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.513 0.725 . . . . 0.0 109.797 177.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -104.97 138.37 41.29 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 124.883 1.273 . . . . 0.0 110.207 177.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.466 HG13 ' CG ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -133.14 136.0 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 O-C-N 121.28 -0.887 . . . . 0.0 111.866 -177.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -104.35 127.07 58.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 161.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.3 141.93 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.897 1.679 . . . . 0.0 108.787 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 12.7 t70 56.65 -79.92 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 126.225 1.81 . . . . 0.0 113.698 -173.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -161.75 24.99 0.24 Allowed Glycine 0 CA--C 1.536 1.386 0 C-N-CA 129.049 3.214 . . . . 0.0 110.418 175.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -124.35 156.68 36.62 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 128.182 2.593 . . . . 0.0 109.05 -169.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -134.61 136.93 43.27 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.952 0.901 . . . . 0.0 111.4 -175.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -135.1 159.54 41.2 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.17 0.988 . . . . 0.0 111.736 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -131.12 129.21 41.55 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.727 2.011 . . . . 0.0 108.388 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.77 117.86 3.02 Favored Glycine 0 C--O 1.227 -0.301 0 C-N-CA 124.828 1.204 . . . . 0.0 110.293 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.5 p -104.72 116.32 31.83 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.475 1.11 . . . . 0.0 109.421 -173.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.404 ' HA3' ' N ' ' A' ' 54' ' ' ALA . . . -142.32 135.89 6.9 Favored Glycine 0 C--O 1.228 -0.232 0 O-C-N 120.941 -1.1 . . . . 0.0 115.592 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.9 ttt85 -40.6 -22.9 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 116.514 2.042 . . . . 0.0 116.514 170.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -153.53 -177.98 6.71 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 124.483 1.113 . . . . 0.0 111.16 147.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.439 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 35.4 mtmt -49.24 -37.5 23.54 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 126.644 1.978 . . . . 0.0 114.797 177.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -13.91 1.69 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 171.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.6 tp -121.58 -44.48 2.34 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.99 2.116 . . . . 0.0 110.26 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.439 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.66 -57.19 13.01 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 125.666 1.586 . . . . 0.0 112.4 175.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.501 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.5 ttmt -55.23 -44.28 75.32 Favored 'General case' 0 C--O 1.207 -1.183 0 CA-C-O 116.507 -1.711 . . . . 0.0 110.936 168.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.57 -50.93 68.78 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 121.924 2.147 . . . . 0.0 112.741 179.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 12.6 mmm-85 -54.54 -58.6 6.86 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 127.146 2.178 . . . . 0.0 111.555 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.66 -54.16 47.57 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.941 0.897 . . . . 0.0 112.872 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.92 -55.85 15.19 Favored 'General case' 0 C--O 1.214 -0.766 0 C-N-CA 126.88 2.072 . . . . 0.0 112.863 174.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.21 -47.88 74.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 121.019 1.736 . . . . 0.0 111.406 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.0 m -55.05 -53.61 53.62 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.215 0.606 . . . . 0.0 112.049 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.06 -59.59 4.55 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.398 1.479 . . . . 0.0 111.734 173.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -43.43 -63.46 0.82 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 128.37 2.668 . . . . 0.0 110.627 178.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.95 -49.92 70.19 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.018 0.527 . . . . 0.0 111.082 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 46.4 m -55.24 -71.35 0.09 Allowed 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.276 11.4 m -55.59 -44.22 75.78 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 C-N-CA 124.721 1.208 . . . . 0.0 114.062 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.2 m-30 -55.97 -47.97 76.69 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 170.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -56.44 -36.43 69.01 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-N 120.249 1.386 . . . . 0.0 113.903 168.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -38.1 89.25 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.405 1.082 . . . . 0.0 111.273 172.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.296 17.3 m-70 99.56 43.4 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 131.399 3.88 . . . . 0.0 112.276 175.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 43.6 tp . . . . . 0 C--O 1.252 1.216 0 C-N-CA 127.4 2.28 . . . . 0.0 110.258 171.594 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 CA--C 1.541 0.87 0 N-CA-C 113.812 0.658 . . . . 0.0 113.812 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.0 p -81.11 -8.09 59.69 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -152.85 -173.4 22.2 Favored Glycine 0 CA--C 1.536 1.367 0 C-N-CA 124.893 1.235 . . . . 0.0 114.263 175.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -141.89 28.84 1.72 Allowed 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.917 1.451 . . . . 0.0 114.917 -163.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -116.8 141.19 27.83 Favored Pre-proline 0 CA--C 1.546 0.799 0 C-N-CA 126.303 1.841 . . . . 0.0 108.287 171.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -70.06 -39.74 5.61 Favored 'Trans proline' 0 C--N 1.349 0.603 0 CA-C-N 120.915 1.363 . . . . 0.0 113.607 -169.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.446 HG22 ' HB3' ' A' ' 55' ' ' LYS . 59.9 t -54.46 -52.95 34.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -55.91 -53.02 61.93 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 116.051 1.871 . . . . 0.0 116.051 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 10.1 pt -57.66 -48.21 83.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 119.27 0.941 . . . . 0.0 113.507 171.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -55.71 -41.51 73.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 174.455 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -55.13 -56.67 17.28 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.527 1.931 . . . . 0.0 111.804 171.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . 0.274 1.8 pt-20 -57.39 -59.78 4.63 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 175.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 81.6 mt -55.8 -33.71 64.66 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 176.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.277 0.0 OUTLIER 15.04 67.87 0.16 Allowed Pre-proline 0 N--CA 1.487 1.415 0 C-N-CA 129.523 3.129 . . . . 0.0 118.092 -175.633 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.17 43.14 0.09 OUTLIER 'Trans proline' 0 CA--C 1.558 1.683 1 C-N-CA 125.921 4.414 . . . . 0.0 118.848 -175.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 83.45 32.85 24.05 Favored Glycine 0 CA--C 1.533 1.212 0 O-C-N 120.065 -1.647 . . . . 0.0 113.771 177.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -103.8 166.63 10.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -166.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -134.79 138.77 44.57 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 126.922 2.089 . . . . 0.0 111.692 174.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -104.54 135.26 46.29 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 124.715 1.206 . . . . 0.0 111.025 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -118.51 135.27 54.49 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 127.619 2.368 . . . . 0.0 109.261 178.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -108.66 124.78 51.05 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 122.331 1.062 . . . . 0.0 111.874 -174.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.417 ' HB2' HG13 ' A' ' 34' ' ' VAL . 3.8 mp -131.9 167.51 19.49 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 129.895 3.278 . . . . 0.0 106.309 -173.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.9 p -141.51 168.82 18.85 Favored 'General case' 0 C--N 1.321 -0.638 0 O-C-N 119.937 -1.727 . . . . 0.0 113.168 159.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.278 3.4 tp10 122.92 7.34 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 128.223 2.609 . . . . 0.0 113.65 142.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -62.44 32.93 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 130.205 3.402 . . . . 0.0 115.989 175.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.4 169.66 16.46 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 126.277 1.894 . . . . 0.0 113.597 -170.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -69.22 170.25 10.54 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.684 1.194 . . . . 0.0 113.193 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 72.8 p -70.36 40.26 0.05 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 125.727 1.611 . . . . 0.0 113.102 162.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -153.5 -40.11 0.1 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 126.558 1.943 . . . . 0.0 112.63 -171.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -154.55 154.43 33.07 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.918 0.887 . . . . 0.0 112.9 -176.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -64.62 158.12 25.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.322 1.449 . . . . 0.0 114.347 -178.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.3 m -135.22 135.6 41.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 113.853 -1.521 . . . . 0.0 109.57 152.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -96.74 135.52 38.57 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 105.184 -2.154 . . . . 0.0 105.184 170.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.417 HG13 ' HB2' ' A' ' 22' ' ' LEU 0.327 0.1 OUTLIER -107.53 135.02 47.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 122.745 1.26 . . . . 0.0 112.561 175.759 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 76.1 mmm -125.16 117.33 23.64 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.406 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.3 m -115.83 135.19 54.24 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.386 0.674 . . . . 0.0 109.709 -172.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -121.33 135.81 60.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 124.446 1.098 . . . . 0.0 112.067 -174.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.3 t -104.41 125.98 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 165.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.3 p -146.71 145.37 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 126.878 2.071 . . . . 0.0 109.095 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 20.5 t70 62.16 -23.66 0.05 OUTLIER 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 116.979 2.214 . . . . 0.0 116.979 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 130.62 3.78 4.52 Favored Glycine 0 CA--C 1.544 1.87 0 C-N-CA 126.569 2.033 . . . . 0.0 113.585 -167.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -135.02 165.7 24.74 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.192 2.197 . . . . 0.0 111.832 -173.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -134.23 137.22 44.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.365 1.066 . . . . 0.0 112.689 -163.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -135.03 150.72 50.35 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.131 1.773 . . . . 0.0 110.809 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -132.53 110.55 10.56 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.288 1.035 . . . . 0.0 110.557 -174.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -104.97 109.1 3.21 Favored Glycine 0 CA--C 1.527 0.792 0 C-N-CA 126.018 1.771 . . . . 0.0 112.018 -172.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 74.0 m -108.02 104.94 14.49 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 118.052 0.926 . . . . 0.0 112.601 -172.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.45 136.46 7.89 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 125.832 1.682 . . . . 0.0 114.791 -172.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 57.6 mmt-85 -13.63 -59.1 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 127.057 2.143 . . . . 0.0 116.739 172.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -136.94 177.2 8.05 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 126.067 1.747 . . . . 0.0 109.908 169.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -46.88 -46.01 20.82 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 120.015 1.28 . . . . 0.0 114.093 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.63 -23.43 1.7 Allowed 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 174.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 22.3 tp -108.39 -40.19 5.21 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.235 1.414 . . . . 0.0 111.31 175.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.39 -56.83 15.63 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.694 1.197 . . . . 0.0 112.575 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.446 ' HB3' HG22 ' A' ' 7' ' ' VAL . 11.0 mmtt -55.41 -35.63 65.56 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-O 115.698 -2.096 . . . . 0.0 113.249 165.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.55 -54.81 39.36 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 122.501 2.41 . . . . 0.0 110.94 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -55.0 -53.26 58.04 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 127.305 2.242 . . . . 0.0 114.05 169.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.51 -56.67 17.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.225 1.01 . . . . 0.0 111.952 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.33 -60.07 2.55 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 124.291 1.036 . . . . 0.0 113.207 166.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -50.51 -48.43 57.03 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.336 1.454 . . . . 0.0 112.92 -177.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.12 -59.16 5.15 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 112.486 173.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.17 -57.1 13.13 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.869 -1.062 . . . . 0.0 111.998 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -42.15 -64.32 0.61 Allowed 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.288 2.635 . . . . 0.0 111.121 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.32 -50.82 66.49 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.129 0.422 . . . . 0.0 111.092 -178.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 41.0 m -55.44 -73.17 0.06 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 175.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.253 11.6 m -55.52 -42.02 66.27 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 124.73 1.212 . . . . 0.0 113.845 -176.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.4 m-30 -56.63 -47.02 80.59 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 119.638 1.108 . . . . 0.0 113.4 169.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 t30 -55.3 -33.8 63.58 Favored 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 169.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.3 mt -63.4 -59.11 5.12 Favored 'General case' 0 N--CA 1.479 1.018 0 CA-C-N 119.242 0.928 . . . . 0.0 110.746 167.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -169.3 -42.18 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.652 1.581 . . . . 0.0 113.896 164.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.247 0.955 0 C-N-CA 127.54 2.336 . . . . 0.0 111.152 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo . . . . . 0 CA--C 1.54 0.824 0 CA-C-O 119.565 -0.265 . . . . 0.0 112.488 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.7 m 50.38 29.38 3.83 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 124.654 1.182 . . . . 0.0 113.016 -161.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 161.07 170.35 25.57 Favored Glycine 0 CA--C 1.537 1.425 0 C-N-CA 127.637 2.542 . . . . 0.0 110.824 -166.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -148.31 165.47 30.93 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.614 1.166 . . . . 0.0 113.821 -171.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -58.53 142.56 82.49 Favored Pre-proline 0 CA--C 1.557 1.229 0 C-N-CA 126.473 1.909 . . . . 0.0 113.607 -172.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.28 -37.78 5.47 Favored 'Trans proline' 0 C--N 1.353 0.801 0 C-N-CA 122.72 2.28 . . . . 0.0 114.58 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.426 HG22 ' HB3' ' A' ' 55' ' ' LYS . 42.3 t -54.99 -50.95 58.45 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 CA-C-O 122.152 0.977 . . . . 0.0 109.067 172.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -55.54 -49.99 71.19 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 116.185 1.92 . . . . 0.0 116.185 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.258 10.7 pt -58.8 -48.89 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 CA-C-N 120.653 1.569 . . . . 0.0 114.563 167.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.283 0.0 OUTLIER -55.53 -39.95 71.21 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 121.022 -1.049 . . . . 0.0 113.434 176.045 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -58.57 7.12 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.614 1.966 . . . . 0.0 112.117 167.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -55.8 -54.93 38.46 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.408 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 11.5 mt -55.9 -42.19 75.64 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.139 1.375 . . . . 0.0 114.584 172.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 ptp180 27.38 65.17 0.59 Allowed Pre-proline 0 N--CA 1.48 1.052 0 C-N-CA 128.369 2.668 . . . . 0.0 116.202 -171.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -58.97 74.74 0.05 OUTLIER 'Trans proline' 0 CA--C 1.553 1.428 0 C-N-CA 124.953 3.769 . . . . 0.0 117.117 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.86 35.15 89.73 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.691 1.615 . . . . 0.0 114.936 173.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 pp -111.81 157.46 20.55 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -154.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.78 141.09 44.74 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 127.419 2.288 . . . . 0.0 114.175 167.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 50.0 m-85 -104.48 135.36 46.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.451 1.101 . . . . 0.0 111.44 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -106.58 135.43 48.12 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.909 2.083 . . . . 0.0 110.064 171.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 67.5 t80 -104.58 129.69 52.65 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 123.312 1.53 . . . . 0.0 110.877 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mp -134.76 145.33 48.32 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 130.369 3.468 . . . . 0.0 105.944 -168.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.6 t -144.74 74.15 1.4 Allowed 'General case' 0 C--N 1.317 -0.845 0 O-C-N 118.921 -2.362 . . . . 0.0 108.264 -171.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -166.19 -12.77 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 1 N-CA-C 123.286 4.55 . . . . 0.0 123.286 -152.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -78.04 39.25 0.3 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 122.114 2.233 . . . . 0.0 113.103 -179.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.34 -146.26 5.07 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.932 1.253 . . . . 0.0 113.452 -162.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 67.77 -27.68 0.14 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 129.099 2.96 . . . . 0.0 116.195 174.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.8 t -73.81 0.36 13.42 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.221 1.408 . . . . 0.0 112.666 159.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -148.89 -59.24 0.22 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 125.548 1.539 . . . . 0.0 112.454 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -158.75 159.29 35.04 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.96 2.104 . . . . 0.0 109.708 176.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 tptp -62.1 133.77 55.71 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 119.265 0.939 . . . . 0.0 112.39 -176.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.6 m -132.26 133.51 44.19 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.615 1.166 . . . . 0.0 111.453 173.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -104.98 135.05 47.04 Favored 'General case' 0 CA--C 1.509 -0.624 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 174.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 98.0 t -118.07 134.88 60.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 CA-C-O 123.3 1.524 . . . . 0.0 109.45 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.06 124.29 46.55 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 171.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 12.3 t -120.22 134.35 55.28 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.676 0.671 . . . . 0.0 111.139 169.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.7 t -121.51 135.63 61.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 123.548 0.739 . . . . 0.0 110.322 -169.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.5 t -94.85 114.27 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 170.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.2 t -138.52 137.0 43.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 126.596 1.958 . . . . 0.0 108.337 -168.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.2 t70 59.02 -66.34 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.75 2.02 . . . . 0.0 114.044 -170.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 18.97 0.06 OUTLIER Glycine 0 CA--C 1.542 1.737 0 C-N-CA 128.031 2.729 . . . . 0.0 112.692 170.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -135.21 165.11 26.17 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.931 2.492 . . . . 0.0 110.944 -168.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -127.01 128.68 46.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.756 0.822 . . . . 0.0 112.508 -162.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -135.11 103.3 5.5 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.445 1.098 . . . . 0.0 113.533 -164.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.5 mp0 -77.84 135.26 37.9 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 127.605 2.362 . . . . 0.0 110.432 173.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.98 123.67 3.19 Favored Glycine 0 CA--C 1.527 0.79 0 C-N-CA 125.948 1.737 . . . . 0.0 110.34 174.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.2 t -113.63 113.01 24.45 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 123.817 0.847 . . . . 0.0 111.175 -173.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.74 149.91 20.17 Favored Glycine 0 CA--C 1.529 0.939 0 C-N-CA 125.387 1.47 . . . . 0.0 115.767 -174.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -53.32 -23.01 8.17 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 175.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -157.7 -174.82 5.05 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 125.94 1.696 . . . . 0.0 110.288 152.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -45.19 -49.24 12.31 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.993 1.717 . . . . 0.0 114.27 -178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.38 -14.15 1.13 Allowed 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 115.896 1.813 . . . . 0.0 115.896 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 24.5 tp -114.66 -41.31 3.43 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.334 1.854 . . . . 0.0 111.294 172.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -55.29 33.47 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.155 1.382 . . . . 0.0 112.371 174.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.426 ' HB3' HG22 ' A' ' 7' ' ' VAL . 13.5 mmtt -55.35 -41.93 73.2 Favored 'General case' 0 C--O 1.21 -1.0 0 CA-C-O 115.413 -2.232 . . . . 0.0 113.593 162.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -50.19 70.59 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 123.444 2.838 . . . . 0.0 111.17 -178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.6 mmt-85 -54.99 -58.16 8.77 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 129.222 3.009 . . . . 0.0 113.259 168.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -56.38 20.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.673 1.189 . . . . 0.0 112.168 179.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -44.86 -60.33 2.1 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.271 1.428 . . . . 0.0 114.454 164.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -55.01 -45.45 75.1 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.794 1.179 . . . . 0.0 112.716 -177.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 20.3 m -55.48 -56.84 15.56 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.32 1.048 . . . . 0.0 112.507 171.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -59.35 4.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.62 1.168 . . . . 0.0 112.24 177.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.42 -57.62 5.82 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 126.871 2.068 . . . . 0.0 111.884 178.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.97 -49.07 72.33 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.133 0.424 . . . . 0.0 111.331 178.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 74.9 m -55.28 -68.06 0.22 Allowed 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 173.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.3 m -55.47 -46.99 78.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -177.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.408 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 8.8 m-30 -55.94 -48.34 75.92 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.461 1.282 . . . . 0.0 114.461 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.65 -38.07 69.08 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.054 0.843 . . . . 0.0 112.556 170.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.5 -60.18 3.9 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.504 1.122 . . . . 0.0 110.181 168.246 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -173.89 169.98 3.99 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.158 1.783 . . . . 0.0 114.32 158.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 44.8 tp . . . . . 0 C--O 1.251 1.184 0 C-N-CA 127.254 2.221 . . . . 0.0 111.198 167.819 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_exo . . . . . 0 N--CA 1.483 0.887 0 N-CA-C 110.528 -0.605 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 p 55.03 176.33 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.796 1.239 . . . . 0.0 113.124 -135.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -166.94 177.93 41.42 Favored Glycine 0 CA--C 1.53 1.022 0 O-C-N 121.018 -1.051 . . . . 0.0 114.037 -175.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.7 tttt -68.59 -8.36 41.09 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -167.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -148.13 157.2 43.2 Favored Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 125.5 1.52 . . . . 0.0 110.562 171.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -66.53 -31.83 40.73 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.41 2.073 . . . . 0.0 114.659 -175.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.531 HG13 ' HG2' ' A' ' 55' ' ' LYS . 95.5 t -54.78 -50.83 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -55.29 -44.45 75.74 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.993 1.317 . . . . 0.0 114.401 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.438 ' H ' HG13 ' A' ' 9' ' ' ILE . 8.5 mt -55.92 -59.51 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 125.254 1.422 . . . . 0.0 112.316 168.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.264 0.0 OUTLIER -55.54 -39.31 70.4 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.696 0.798 . . . . 0.0 112.447 -179.556 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -55.58 -57.71 10.8 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 127.538 2.335 . . . . 0.0 112.163 168.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -55.37 -58.05 9.34 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.601 1.56 . . . . 0.0 112.001 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 13.3 mt -55.82 -35.76 66.73 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.423 ' HA ' ' HD2' ' A' ' 15' ' ' PRO 0.366 0.0 OUTLIER -10.11 90.71 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.238 0 C-N-CA 127.835 2.454 . . . . 0.0 117.387 -161.883 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.423 ' HD2' ' HA ' ' A' ' 14' ' ' ARG . 74.0 Cg_endo -66.98 -166.1 0.11 Allowed 'Trans proline' 0 CA--C 1.549 1.234 0 C-N-CA 122.457 2.105 . . . . 0.0 111.544 169.251 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.43 66.04 0.4 Allowed Glycine 0 CA--C 1.539 1.547 0 O-C-N 120.631 -1.293 . . . . 0.0 114.117 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.9 pp -112.0 167.14 10.62 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.848 1.659 . . . . 0.0 113.343 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 pttp -135.23 138.87 43.99 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.54 1.536 . . . . 0.0 112.443 167.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -104.25 135.24 46.09 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.353 1.073 . . . . 0.0 109.62 172.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -114.08 135.33 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 127.83 2.452 . . . . 0.0 108.568 178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -107.04 119.65 39.96 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 122.351 1.072 . . . . 0.0 111.147 -176.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -124.38 150.48 45.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 129.827 3.251 . . . . 0.0 106.808 -177.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.2 p -123.93 134.19 53.57 Favored 'General case' 0 C--N 1.321 -0.671 0 O-C-N 120.343 -1.473 . . . . 0.0 112.068 174.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.341 6.0 mm-40 97.9 60.4 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 127.73 2.412 . . . . 0.0 115.339 162.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.0 t -64.41 114.04 4.04 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 138.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -147.03 -173.44 18.25 Favored Glycine 0 CA--C 1.539 1.537 0 O-C-N 121.386 -0.821 . . . . 0.0 114.453 -163.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.28 -146.74 0.07 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 129.101 2.96 . . . . 0.0 112.153 1.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.1 m -54.96 -15.79 2.26 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 117.033 2.234 . . . . 0.0 117.033 -170.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -69.26 -36.82 77.52 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 119.618 1.099 . . . . 0.0 112.632 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -97.2 -43.96 7.14 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.443 1.097 . . . . 0.0 112.214 176.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 tptt 29.23 53.65 0.1 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 129.09 2.956 . . . . 0.0 114.577 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.3 m -112.88 137.19 51.61 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 126.53 1.932 . . . . 0.0 112.51 -159.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -93.86 135.74 34.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 103.994 -2.595 . . . . 0.0 103.994 177.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -116.49 114.16 45.18 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -158.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 72.9 mmm -104.72 118.49 36.7 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 178.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 17.2 m -123.72 135.29 53.77 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.819 -176.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -134.27 135.88 53.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 C-N-CA 123.714 0.806 . . . . 0.0 109.671 -158.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 68.0 t -104.13 112.85 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 171.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.0 t -137.96 136.35 45.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 126.893 2.077 . . . . 0.0 107.963 -164.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.1 t70 59.83 -65.62 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 127.213 2.205 . . . . 0.0 114.167 -171.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -174.92 20.66 0.05 OUTLIER Glycine 0 CA--C 1.537 1.433 0 C-N-CA 128.117 2.77 . . . . 0.0 112.033 174.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.09 166.84 22.13 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 127.248 2.219 . . . . 0.0 109.613 -167.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -121.87 138.53 54.36 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.995 0.918 . . . . 0.0 111.779 -175.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -134.77 148.3 50.2 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 126.083 1.753 . . . . 0.0 109.519 -173.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -133.94 131.49 39.09 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.618 1.167 . . . . 0.0 109.985 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -129.37 113.45 1.52 Allowed Glycine 0 CA--C 1.522 0.474 0 C-N-CA 125.077 1.322 . . . . 0.0 111.381 -173.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.0 p -104.81 104.69 14.51 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.115 0.966 . . . . 0.0 111.171 -172.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.01 137.97 9.54 Favored Glycine 0 CA--C 1.525 0.692 0 C-N-CA 124.496 1.046 . . . . 0.0 115.42 -176.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 20.1 mmt180 -35.76 -44.41 0.34 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 115.383 1.623 . . . . 0.0 115.383 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -139.97 179.19 6.75 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.292 1.037 . . . . 0.0 111.171 158.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 54.2 mttp -47.25 -35.1 7.25 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 126.589 1.955 . . . . 0.0 115.838 178.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.07 -15.4 5.21 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 172.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.5 tp -124.04 -41.74 2.19 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.267 2.227 . . . . 0.0 110.728 -179.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.432 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.7 -58.27 8.5 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.967 1.307 . . . . 0.0 112.912 172.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.531 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.0 ttmt -55.25 -46.34 76.08 Favored 'General case' 0 C--O 1.21 -1.016 0 CA-C-O 116.886 -1.531 . . . . 0.0 110.127 169.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.18 -47.59 75.0 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 121.594 1.997 . . . . 0.0 113.174 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -55.39 -57.5 11.61 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 170.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.93 49.92 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.489 0.716 . . . . 0.0 112.574 178.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -50.19 -59.11 4.25 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.635 2.374 . . . . 0.0 112.455 172.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.12 -49.42 71.82 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 119.998 1.272 . . . . 0.0 111.687 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.7 m -55.42 -55.07 35.87 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.029 0.932 . . . . 0.0 112.542 175.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -55.74 27.8 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.769 1.228 . . . . 0.0 111.841 175.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.42 -57.82 2.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.481 2.312 . . . . 0.0 110.68 175.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.87 -54.17 45.98 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 122.834 0.454 . . . . 0.0 111.638 178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.3 m -55.15 -68.69 0.17 Allowed 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 175.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.278 21.1 m -55.51 -46.15 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -176.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -57.74 -46.66 84.17 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 172.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.72 -36.79 67.62 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 120.391 1.45 . . . . 0.0 113.635 169.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.13 -42.92 99.59 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.864 1.265 . . . . 0.0 111.466 169.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.286 25.4 m-70 103.9 39.68 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 131.393 3.877 . . . . 0.0 112.825 174.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 61.5 mt . . . . . 0 C--O 1.253 1.27 0 C-N-CA 126.598 1.959 . . . . 0.0 112.906 174.879 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_exo . . . . . 0 N--CA 1.489 1.255 0 N-CA-C 110.805 -0.498 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 p -59.3 160.88 6.06 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 122.079 -0.388 . . . . 0.0 111.44 139.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.5 -31.29 0.08 OUTLIER Glycine 0 CA--C 1.536 1.376 0 N-CA-C 116.376 1.31 . . . . 0.0 116.376 175.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.3 tttm -151.3 25.27 0.71 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.007 1.323 . . . . 0.0 112.855 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.9 p-10 -149.07 92.33 4.36 Favored Pre-proline 0 CA--C 1.545 0.766 0 C-N-CA 126.429 1.892 . . . . 0.0 109.298 -158.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -64.25 -35.12 53.44 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.328 2.019 . . . . 0.0 115.275 -159.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.449 HG22 ' HB3' ' A' ' 55' ' ' LYS . 59.5 t -46.87 -58.59 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 124.117 0.967 . . . . 0.0 109.264 169.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 19.0 tpp -55.69 -43.91 76.85 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 125.7 1.6 . . . . 0.0 114.412 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 20.1 mt -55.59 -59.67 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 CA-C-N 119.389 0.995 . . . . 0.0 110.928 173.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.419 ' HB2' HD13 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -50.28 -48.41 54.99 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.489 1.516 . . . . 0.0 111.236 176.278 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -57.89 -55.38 35.59 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 124.72 1.208 . . . . 0.0 113.881 177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -56.45 -45.3 80.89 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.274 1.83 . . . . 0.0 113.765 174.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.58 -37.68 68.38 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.201 1.8 . . . . 0.0 112.951 169.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.8 ptt-85 34.8 66.4 1.49 Allowed Pre-proline 0 N--CA 1.485 1.298 0 C-N-CA 127.63 2.372 . . . . 0.0 114.412 -178.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.71 60.64 1.19 Allowed 'Trans proline' 0 CA--C 1.548 1.215 0 C-N-CA 124.922 3.748 . . . . 0.0 113.06 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.92 25.99 64.81 Favored Glycine 0 CA--C 1.534 1.268 0 C-N-CA 126.019 1.771 . . . . 0.0 115.064 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.413 ' HB3' HG12 ' A' ' 39' ' ' VAL . 1.1 pp -79.06 162.05 26.15 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 116.432 2.012 . . . . 0.0 116.432 -159.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -135.21 137.18 42.39 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.303 2.241 . . . . 0.0 110.713 164.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -104.39 135.32 46.05 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 124.587 1.18 . . . . 0.0 111.465 178.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -121.28 135.57 55.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 127.614 2.366 . . . . 0.0 109.68 -177.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -104.49 124.16 48.78 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 122.772 1.272 . . . . 0.0 109.811 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.429 ' CB ' HG13 ' A' ' 34' ' ' VAL . 1.3 mm? -123.84 159.46 29.53 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 130.239 3.416 . . . . 0.0 103.645 178.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 88.6 p -149.87 115.36 5.52 Favored 'General case' 0 N--CA 1.473 0.711 0 O-C-N 118.753 -2.467 . . . . 0.0 112.847 167.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -162.27 0.01 0.05 OUTLIER 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.266 1.426 . . . . 0.0 113.392 -165.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 14.3 t -83.95 11.86 7.12 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.22 1.408 . . . . 0.0 113.552 -169.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 158.06 117.46 0.51 Allowed Glycine 0 CA--C 1.525 0.694 0 C-N-CA 125.296 1.427 . . . . 0.0 110.766 -170.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 37.0 mm-40 -112.84 -4.04 14.05 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.29 1.036 . . . . 0.0 113.254 -172.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.6 m -75.06 48.87 0.41 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 127.544 2.338 . . . . 0.0 113.662 -174.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 26.4 t60 64.25 -32.12 0.13 Allowed 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 129.426 3.091 . . . . 0.0 115.774 -172.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.96 58.9 0.16 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.614 1.966 . . . . 0.0 111.462 164.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -55.24 133.09 49.1 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.083 1.753 . . . . 0.0 112.27 -171.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.7 m -135.13 135.82 41.43 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 123.184 1.469 . . . . 0.0 113.807 -158.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -104.6 135.24 46.38 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.607 -152.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.429 HG13 ' CB ' ' A' ' 22' ' ' LEU 0.258 0.1 OUTLIER -104.96 134.5 46.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 122.843 1.306 . . . . 0.0 111.768 167.38 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 67.1 mmm -117.76 127.13 53.61 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -122.96 135.24 54.41 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -174.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.4 m -119.58 135.71 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.409 0 C-N-CA 123.956 0.902 . . . . 0.0 111.076 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.8 t -102.25 124.67 56.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 N-CA-C 104.87 -2.27 . . . . 0.0 104.87 161.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.413 HG12 ' HB3' ' A' ' 17' ' ' LEU . 4.8 m -138.29 150.28 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 126.936 2.094 . . . . 0.0 108.159 -173.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.2 t70 54.97 -79.28 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 125.204 1.401 . . . . 0.0 113.552 -175.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -159.67 20.9 0.27 Allowed Glycine 0 CA--C 1.544 1.844 0 C-N-CA 127.988 2.709 . . . . 0.0 112.5 167.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -135.13 170.29 16.14 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.834 2.453 . . . . 0.0 112.583 -172.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -134.5 136.44 43.13 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.92 0.888 . . . . 0.0 112.991 -162.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.421 ' HZ ' HG21 ' A' ' 65' ' ' THR . 44.1 m-85 -134.98 149.6 50.22 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.049 1.74 . . . . 0.0 111.102 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -132.27 125.95 32.24 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.897 1.279 . . . . 0.0 109.846 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.05 112.91 2.12 Favored Glycine 0 CA--C 1.527 0.793 0 C-N-CA 126.019 1.771 . . . . 0.0 111.569 -169.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -104.9 112.84 26.12 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.432 1.116 . . . . 0.0 111.059 -170.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.69 136.42 8.46 Favored Glycine 0 CA--C 1.538 1.53 0 C-N-CA 125.694 1.616 . . . . 0.0 116.702 -165.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.1 mmm-85 -55.51 -13.81 1.72 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 170.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -152.88 165.59 34.96 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 128.186 2.594 . . . . 0.0 109.139 169.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -51.37 -42.83 61.63 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 121.158 1.799 . . . . 0.0 113.376 167.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -5.7 3.44 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 115.826 1.787 . . . . 0.0 115.826 174.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.58 -50.93 3.03 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.214 1.406 . . . . 0.0 109.067 170.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.36 -59.4 4.85 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.594 1.958 . . . . 0.0 113.459 179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.449 ' HB3' HG22 ' A' ' 7' ' ' VAL . 6.7 mmtt -55.53 -38.34 69.11 Favored 'General case' 0 C--O 1.208 -1.109 0 CA-C-O 115.479 -2.2 . . . . 0.0 113.081 163.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.4 -50.77 68.89 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 123.462 2.847 . . . . 0.0 111.944 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.7 mmp_? -55.34 -58.25 8.49 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 130.269 3.428 . . . . 0.0 113.347 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.4 -56.31 21.6 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 125.066 1.347 . . . . 0.0 111.593 176.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.68 -55.28 11.77 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 114.765 1.394 . . . . 0.0 114.765 168.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -55.1 -47.75 74.52 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 120.822 1.646 . . . . 0.0 112.911 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -55.12 -56.69 16.98 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.54 1.136 . . . . 0.0 112.298 172.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.19 -55.04 35.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.638 1.175 . . . . 0.0 112.279 176.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.419 HD13 ' HB2' ' A' ' 10' ' ' LEU . 0.0 OUTLIER -48.37 -60.83 2.36 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 127.762 2.425 . . . . 0.0 109.8 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.09 -48.45 73.55 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 122.774 0.43 . . . . 0.0 111.31 -179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.421 HG21 ' HZ ' ' A' ' 44' ' ' PHE . 49.2 m -55.37 -69.3 0.14 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.772 1.026 . . . . 0.0 113.772 173.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.4 m -55.27 -41.33 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 119.287 0.948 . . . . 0.0 112.957 -177.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.6 m-30 -56.23 -45.24 80.05 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 120.82 -1.175 . . . . 0.0 113.724 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -36.53 67.2 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 164.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.4 mt -67.89 -23.25 65.09 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 119.518 1.054 . . . . 0.0 112.598 169.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.27 12.6 m-70 77.25 45.47 0.08 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 128.772 2.829 . . . . 0.0 112.169 -175.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 tp . . . . . 0 C--O 1.25 1.093 0 C-N-CA 127.963 2.505 . . . . 0.0 111.703 -179.729 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo . . . . . 0 N--CA 1.483 0.906 0 N-CA-C 112.851 0.289 . . . . 0.0 112.851 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 p -114.31 -6.16 12.95 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.085 1.354 . . . . 0.0 114.386 -173.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 179.56 169.25 39.66 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 125.445 1.497 . . . . 0.0 112.877 174.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -73.17 -23.77 60.48 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.977 0.911 . . . . 0.0 112.781 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -162.25 166.05 14.7 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 128.79 2.836 . . . . 0.0 108.293 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -64.53 -31.65 60.26 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 121.999 1.8 . . . . 0.0 114.77 -176.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.712 HG13 ' HG2' ' A' ' 55' ' ' LYS . 57.3 t -55.06 -50.28 64.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 173.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -55.08 -45.06 75.37 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.682 1.193 . . . . 0.0 113.208 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 12.2 mt -55.65 -63.6 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 124.342 1.057 . . . . 0.0 110.874 172.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -41.69 72.92 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.964 0.906 . . . . 0.0 112.842 -176.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -55.36 -63.64 1.1 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.093 1.757 . . . . 0.0 111.442 174.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 35.0 tp10 -56.01 -48.9 75.05 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 115.461 1.652 . . . . 0.0 115.461 175.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.403 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 1.7 mt -55.66 -35.0 65.48 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 172.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.2 ptt-85 33.94 59.16 1.95 Allowed Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 127.259 2.224 . . . . 0.0 115.2 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -68.01 70.78 0.84 Allowed 'Trans proline' 0 CA--C 1.548 1.203 0 C-N-CA 124.665 3.577 . . . . 0.0 114.241 -178.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 62.16 30.02 74.58 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.966 1.746 . . . . 0.0 114.911 173.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -99.6 163.88 12.31 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 117.115 2.265 . . . . 0.0 117.115 -156.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.37 141.95 45.64 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 127.127 2.171 . . . . 0.0 112.065 161.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.428 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 29.7 m-85 -104.57 135.24 46.35 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 122.413 1.102 . . . . 0.0 110.874 176.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -107.46 135.73 48.44 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 128.478 2.711 . . . . 0.0 109.9 175.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -104.61 127.98 52.5 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 122.751 1.262 . . . . 0.0 110.352 174.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.4 mp -134.9 135.83 41.89 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 130.014 3.326 . . . . 0.0 106.11 -171.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 36.9 t -71.83 -28.08 63.34 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 118.476 2.769 . . . . 0.0 118.476 -166.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -143.65 -36.7 0.35 Allowed 'General case' 0 N--CA 1.482 1.15 0 O-C-N 116.582 -3.824 . . . . 0.0 110.053 -45.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.9 t -75.71 77.77 2.67 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.311 2.245 . . . . 0.0 111.602 -171.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.77 -60.31 0.08 OUTLIER Glycine 0 CA--C 1.54 1.637 0 C-N-CA 125.108 1.337 . . . . 0.0 113.051 166.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -58.62 -49.32 77.94 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 121.106 2.453 . . . . 0.0 111.119 -10.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.4 p -92.06 -35.97 13.62 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 126.508 1.923 . . . . 0.0 113.444 173.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -54.91 -27.98 47.21 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 125.924 1.69 . . . . 0.0 114.848 -172.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -135.4 23.46 3.45 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.637 1.575 . . . . 0.0 112.335 175.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -16.74 89.73 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 129.236 3.015 . . . . 0.0 115.867 -166.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.7 m -133.37 135.75 44.91 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 126.784 2.034 . . . . 0.0 109.287 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 6.6 m-30 -96.59 135.88 37.88 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 105.369 -2.086 . . . . 0.0 105.369 -178.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.9 t -115.31 125.64 72.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-O 123.382 1.563 . . . . 0.0 108.696 -161.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.6 mmt -112.34 122.58 48.13 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.019 -1.446 . . . . 0.0 107.731 173.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -122.82 135.52 54.56 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.428 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -128.62 135.68 61.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.14 0.976 . . . . 0.0 111.365 -168.113 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.5 t -104.23 122.96 57.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 105.619 -1.993 . . . . 0.0 105.619 166.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -142.33 151.08 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.325 1.85 . . . . 0.0 108.37 -175.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.5 t70 58.01 -70.5 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.328 1.851 . . . . 0.0 114.13 -178.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -167.22 18.45 0.09 OUTLIER Glycine 0 CA--C 1.543 1.817 0 C-N-CA 128.037 2.732 . . . . 0.0 112.946 167.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -135.33 169.45 17.46 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 127.756 2.422 . . . . 0.0 112.382 -168.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -134.21 138.83 45.38 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.466 1.106 . . . . 0.0 113.524 -166.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -135.12 158.75 43.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.874 1.67 . . . . 0.0 112.318 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.9 mp0 -128.75 135.05 48.67 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.892 2.077 . . . . 0.0 109.449 175.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.86 122.21 3.13 Favored Glycine 0 CA--C 1.524 0.646 0 C-N-CA 125.494 1.521 . . . . 0.0 111.304 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 m -118.07 104.74 11.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 117.896 0.848 . . . . 0.0 110.903 -168.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 146.2 18.19 Favored Glycine 0 CA--C 1.533 1.172 0 C-N-CA 126.43 1.967 . . . . 0.0 114.347 -170.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -44.71 -33.06 1.71 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 116.024 1.861 . . . . 0.0 116.024 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -155.51 179.31 9.3 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.881 1.672 . . . . 0.0 109.684 162.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 37.5 mtmt -43.39 -41.87 4.39 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 127.636 2.374 . . . . 0.0 115.709 -179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.99 -15.92 4.16 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 174.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -122.92 -42.48 2.29 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.931 2.092 . . . . 0.0 111.297 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.42 -57.89 10.02 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.227 1.411 . . . . 0.0 112.295 172.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.712 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.7 ttmt -55.37 -44.46 76.05 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-O 117.586 -1.197 . . . . 0.0 110.863 170.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.15 -51.9 65.0 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 120.341 1.428 . . . . 0.0 113.463 178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.6 mmm-85 -55.36 -53.39 56.8 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.164 1.785 . . . . 0.0 113.24 170.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.79 65.73 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.97 0.908 . . . . 0.0 112.319 177.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.76 -49.71 67.63 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 127.298 2.239 . . . . 0.0 112.403 171.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -55.01 -51.01 67.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.234 1.414 . . . . 0.0 111.822 177.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.6 t -55.26 -54.0 48.97 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.868 0.867 . . . . 0.0 112.812 171.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.23 -55.95 25.48 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.611 1.165 . . . . 0.0 113.19 177.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -59.8 3.5 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 127.826 2.45 . . . . 0.0 110.545 177.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.23 -49.6 69.07 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 123.177 0.298 . . . . 0.0 111.078 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 44.8 m -55.28 -72.33 0.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.541 1.136 . . . . 0.0 113.98 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.251 24.4 m -55.54 -46.17 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -176.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.403 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 5.8 m-30 -59.64 -44.69 93.41 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 174.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -55.58 -39.36 70.6 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 119.916 1.235 . . . . 0.0 113.887 168.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.61 -30.03 71.04 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.579 1.552 . . . . 0.0 112.215 167.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.303 94.2 m-70 76.46 47.31 0.08 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 128.766 2.827 . . . . 0.0 113.166 -173.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.25 1.106 0 C-N-CA 127.531 2.333 . . . . 0.0 110.078 170.531 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.541 0.826 0 N-CA-C 112.342 0.093 . . . . 0.0 112.342 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 84.7 p -71.56 39.74 0.07 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.656 1.982 . . . . 0.0 114.951 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -176.18 -176.86 44.73 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.966 1.269 . . . . 0.0 113.47 -173.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.0 ttpp -66.7 -9.94 41.48 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -169.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -45.54 -57.65 7.31 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 125.657 1.583 . . . . 0.0 114.917 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.72 -31.23 26.21 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.482 2.121 . . . . 0.0 113.627 175.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.711 HG13 ' HG2' ' A' ' 55' ' ' LYS . 60.4 t -55.07 -50.3 64.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 119.165 0.893 . . . . 0.0 109.214 173.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.28 -53.6 54.07 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 124.944 1.298 . . . . 0.0 114.271 -177.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 15.0 pt -58.71 -49.88 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 172.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.4 ' HB2' ' CD1' ' A' ' 63' ' ' LEU 0.252 0.0 OUTLIER -55.59 -45.33 77.42 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 119.663 1.12 . . . . 0.0 113.838 176.981 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -55.13 -56.46 19.67 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 127.106 2.163 . . . . 0.0 111.432 174.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -55.61 -63.82 1.05 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.111 1.364 . . . . 0.0 114.042 173.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.7 mt -55.54 -23.73 28.2 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 35.92 51.21 1.5 Allowed Pre-proline 0 N--CA 1.48 1.07 0 C-N-CA 127.557 2.343 . . . . 0.0 114.778 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.73 46.85 1.99 Allowed 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 124.657 3.571 . . . . 0.0 116.012 -156.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.48 31.04 20.16 Favored Glycine 0 CA--C 1.534 1.251 0 O-C-N 120.521 -1.362 . . . . 0.0 113.538 178.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -97.58 166.27 11.59 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.774 1.63 . . . . 0.0 114.933 -173.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.63 150.77 49.74 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 125.299 1.44 . . . . 0.0 112.654 145.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -104.55 135.83 45.25 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.842 1.257 . . . . 0.0 112.145 179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -124.66 135.72 53.31 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.695 1.598 . . . . 0.0 110.266 166.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -104.42 135.14 46.42 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 123.381 1.562 . . . . 0.0 110.678 -175.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -134.5 161.74 34.21 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 131.691 3.996 . . . . 0.0 106.1 -164.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.7 m -140.81 159.82 41.39 Favored 'General case' 0 C--N 1.319 -0.759 0 O-C-N 119.64 -1.913 . . . . 0.0 112.488 158.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.313 59.3 mm-40 94.26 22.31 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 128.971 2.908 . . . . 0.0 117.283 162.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.4 m -68.2 49.16 0.06 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 125.561 1.544 . . . . 0.0 112.804 161.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -49.89 141.02 15.46 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.997 1.284 . . . . 0.0 112.571 -173.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -129.75 158.89 38.16 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.024 1.33 . . . . 0.0 109.779 -176.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.1 m -57.08 -10.5 1.19 Allowed 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 118.483 2.772 . . . . 0.0 118.483 -148.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -132.23 1.33 3.83 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 126.155 1.782 . . . . 0.0 114.113 176.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -153.88 151.24 29.25 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 -170.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -57.24 153.56 11.82 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.779 2.032 . . . . 0.0 111.497 164.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 72.0 m -130.22 121.85 26.97 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.097 1.359 . . . . 0.0 110.854 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -104.52 135.57 45.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 104.488 -2.412 . . . . 0.0 104.488 155.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 69.2 t -120.76 130.07 74.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.29 1.043 . . . . 0.0 110.841 -159.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 13.5 mmm -109.22 123.23 48.91 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 171.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.6 p -104.88 135.62 45.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.227 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -125.25 135.47 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 O-C-N 121.788 -0.57 . . . . 0.0 111.264 172.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.3 t -104.54 124.16 58.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 106.121 -1.807 . . . . 0.0 106.121 165.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.4 p -152.28 140.96 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.305 1.042 . . . . 0.0 110.174 -174.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.5 t70 62.3 -25.16 0.05 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.937 2.095 . . . . 0.0 116.327 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 133.17 -4.76 4.95 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 126.939 2.209 . . . . 0.0 112.886 -165.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -105.02 168.02 9.33 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.223 2.209 . . . . 0.0 110.808 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -135.09 139.89 45.08 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.076 1.35 . . . . 0.0 110.643 176.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -135.06 150.84 50.34 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.529 1.132 . . . . 0.0 111.041 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -115.29 135.09 54.51 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 126.025 1.73 . . . . 0.0 109.351 166.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -118.62 114.22 2.79 Favored Glycine 0 CA--C 1.519 0.301 0 C-N-CA 125.11 1.338 . . . . 0.0 110.373 168.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.8 p -104.83 108.86 20.57 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 122.577 1.18 . . . . 0.0 109.601 -174.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.44 140.8 11.97 Favored Glycine 0 C--O 1.224 -0.47 0 C-N-CA 126.192 1.853 . . . . 0.0 113.283 -165.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -17.07 6.16 Favored 'General case' 0 CA--C 1.557 1.237 0 O-C-N 121.291 -1.123 . . . . 0.0 113.947 179.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -160.42 162.24 33.2 Favored 'General case' 0 CA--C 1.557 1.218 0 C-N-CA 129.429 3.092 . . . . 0.0 109.584 170.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.46 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 50.2 mttp -43.93 -37.73 3.04 Favored 'General case' 0 N--CA 1.5 2.063 0 CA-C-N 121.707 2.048 . . . . 0.0 115.455 172.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.32 -14.43 7.4 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 120.159 1.345 . . . . 0.0 114.218 174.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.0 tp -122.24 -40.0 2.53 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.294 2.238 . . . . 0.0 111.897 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.67 -55.25 34.33 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.405 -1.434 . . . . 0.0 111.737 173.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.711 ' HG2' HG13 ' A' ' 7' ' ' VAL . 7.5 ttmt -55.32 -41.84 72.96 Favored 'General case' 0 C--O 1.214 -0.808 0 CA-C-O 117.785 -1.102 . . . . 0.0 111.768 168.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.58 -50.78 69.17 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 120.429 1.468 . . . . 0.0 113.677 178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.6 mmm-85 -55.5 -54.06 48.66 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 128.563 2.745 . . . . 0.0 112.661 169.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -53.82 51.39 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.869 1.268 . . . . 0.0 111.672 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.43 -56.82 8.39 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 126.794 2.038 . . . . 0.0 112.269 169.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -52.64 -49.41 65.24 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.112 1.365 . . . . 0.0 112.525 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.22 -57.94 9.72 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.105 1.362 . . . . 0.0 112.165 173.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.464 ' O ' HG22 ' A' ' 66' ' ' VAL . . . -55.18 -56.73 16.62 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.651 1.18 . . . . 0.0 112.354 176.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.4 ' CD1' ' HB2' ' A' ' 10' ' ' LEU . 0.4 OUTLIER -44.5 -63.82 0.82 Allowed 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 128.208 2.603 . . . . 0.0 110.82 176.728 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.48 -51.65 62.05 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 117.82 0.282 . . . . 0.0 110.94 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 13.0 m -55.3 -78.25 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 175.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.464 HG22 ' O ' ' A' ' 62' ' ' ALA . 15.8 m -55.25 -45.75 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 CA-C-N 119.433 1.015 . . . . 0.0 113.179 -174.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -57.64 -45.42 85.49 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 120.755 -1.215 . . . . 0.0 112.539 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . 0.319 8.1 t-20 -57.26 -31.25 65.39 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 116.859 2.17 . . . . 0.0 116.859 164.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.1 mt -61.81 -28.64 69.61 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.709 1.14 . . . . 0.0 113.647 170.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -84.94 -31.66 23.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.081 1.352 . . . . 0.0 114.191 174.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.495 1.518 . . . . 0.0 112.731 177.436 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 N--CA 1.483 0.912 0 N-CA-C 109.245 -1.098 . . . . 0.0 109.245 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.1 m -107.53 1.28 23.27 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -129.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -179.09 162.82 29.98 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.222 0.915 . . . . 0.0 113.154 170.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -68.5 10.22 0.27 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 116.071 1.878 . . . . 0.0 116.071 -174.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -125.32 123.7 25.17 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.901 1.28 . . . . 0.0 110.224 -166.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -65.16 -25.59 57.93 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.132 2.555 . . . . 0.0 115.366 -168.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.742 HG13 ' HG2' ' A' ' 55' ' ' LYS . 46.1 t -53.87 -53.65 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 119.26 0.936 . . . . 0.0 109.208 173.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.3 ttt -55.53 -41.05 72.64 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.352 1.861 . . . . 0.0 114.728 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 19.1 mt -62.2 -59.21 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.789 1.635 . . . . 0.0 112.727 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.268 0.0 OUTLIER -55.48 -35.97 66.11 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.622 0.769 . . . . 0.0 112.426 177.953 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -55.54 -58.37 8.05 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.954 1.702 . . . . 0.0 112.945 162.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.45 -49.69 71.82 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 120.038 -1.664 . . . . 0.0 113.317 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.432 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 8.0 mt -55.91 -42.38 75.94 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 170.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 29.6 ttm105 11.12 80.05 0.06 OUTLIER Pre-proline 0 N--CA 1.49 1.526 0 C-N-CA 129.158 2.983 . . . . 0.0 115.321 -175.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -68.97 -173.18 0.57 Allowed 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.612 2.208 . . . . 0.0 110.516 161.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -71.36 39.9 0.59 Allowed Glycine 0 CA--C 1.541 1.682 0 C-N-CA 125.202 1.382 . . . . 0.0 115.168 176.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -78.6 163.31 25.6 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.655 1.582 . . . . 0.0 112.968 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -135.54 135.95 40.77 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 173.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -104.37 135.55 45.6 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.033 1.333 . . . . 0.0 111.046 -176.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -110.52 135.91 50.45 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 129.415 3.086 . . . . 0.0 110.367 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -104.32 128.21 52.09 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 122.66 1.219 . . . . 0.0 109.984 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.8 mp -135.03 135.74 41.56 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 129.244 3.018 . . . . 0.0 106.599 -170.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.2 m -67.31 -38.69 85.35 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -160.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -145.24 -49.08 0.24 Allowed 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 124.842 3.474 . . . . 0.0 110.099 -43.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.1 t -71.85 33.25 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 128.253 2.621 . . . . 0.0 114.356 -173.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -178.58 14.31 0.03 OUTLIER Glycine 0 CA--C 1.53 1.019 0 O-C-N 120.533 -1.355 . . . . 0.0 114.788 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -61.2 -10.81 7.28 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 118.884 1.342 . . . . 0.0 114.434 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 65.7 p -63.56 -18.4 63.82 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.371 1.869 . . . . 0.0 115.094 168.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 135.44 -32.19 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.432 1 C-N-CA 132.5 4.32 . . . . 0.0 110.519 -179.462 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.92 46.99 0.14 Allowed 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 126.171 1.788 . . . . 0.0 113.581 178.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -43.99 122.65 2.95 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 128.534 2.734 . . . . 0.0 115.582 -161.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.1 m -134.52 135.78 42.6 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.713 2.005 . . . . 0.0 107.194 167.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -103.34 135.84 44.23 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 177.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.0 t -110.14 122.45 64.72 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 CA-C-N 113.384 -1.735 . . . . 0.0 106.793 -169.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 69.0 mmm -113.62 128.79 56.56 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 172.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 15.0 m -131.7 135.14 46.62 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.681 0.613 . . . . 0.0 110.185 -175.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -127.48 135.75 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 121.03 -1.044 . . . . 0.0 110.37 -167.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.4 t -104.16 118.26 51.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 N-CA-C 105.115 -2.179 . . . . 0.0 105.115 168.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 96.6 t -118.69 -35.95 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.349 -159.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -131.26 -13.6 3.45 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.265 . . . . 0.0 113.884 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.33 -17.19 29.07 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 123.905 0.764 . . . . 0.0 112.096 -147.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -104.69 158.92 16.17 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 125.231 1.412 . . . . 0.0 110.747 163.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -135.08 141.09 46.0 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.043 1.737 . . . . 0.0 111.581 -161.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -134.99 127.54 30.71 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.977 1.311 . . . . 0.0 111.62 -171.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -99.23 135.17 41.02 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.215 1.806 . . . . 0.0 109.251 176.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -135.05 115.96 1.48 Allowed Glycine 0 CA--C 1.525 0.669 0 O-C-N 121.65 -0.656 . . . . 0.0 113.381 176.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.7 p -104.89 104.73 14.54 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.18 1.392 . . . . 0.0 111.533 -174.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.4 ' HA3' ' N ' ' A' ' 54' ' ' ALA . . . -135.95 147.27 19.12 Favored Glycine 0 CA--C 1.528 0.906 0 N-CA-C 116.266 1.266 . . . . 0.0 116.266 -173.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -47.91 -26.33 1.67 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 116.563 2.06 . . . . 0.0 116.563 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -152.83 -174.26 4.86 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.824 1.25 . . . . 0.0 109.344 149.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.433 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 6.6 mtmp? -42.36 -38.92 1.99 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 126.522 1.929 . . . . 0.0 114.234 172.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 pttt -45.61 -30.09 1.41 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 126.482 1.913 . . . . 0.0 115.52 171.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.5 tp -122.28 -36.49 2.95 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 111.466 -175.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.433 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.72 -56.31 22.02 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.39 1.476 . . . . 0.0 112.154 170.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.742 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.2 ttmt -55.02 -46.08 75.22 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-O 117.228 -1.368 . . . . 0.0 109.425 169.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -49.19 72.85 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 120.664 1.574 . . . . 0.0 113.064 -179.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.5 mmm180 -55.35 -57.36 12.17 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.824 0.849 . . . . 0.0 113.209 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.47 66.78 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.308 0.643 . . . . 0.0 112.325 179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.39 -53.77 49.55 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 127.969 2.508 . . . . 0.0 113.372 174.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -55.3 -51.44 66.68 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.149 1.34 . . . . 0.0 111.389 176.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.2 m -55.38 -49.34 72.57 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.598 1.159 . . . . 0.0 112.115 177.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.44 ' O ' HG23 ' A' ' 66' ' ' VAL . . . -55.19 -65.7 0.54 Allowed 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 125.393 1.477 . . . . 0.0 111.477 170.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -37.47 -57.71 0.91 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 126.704 2.002 . . . . 0.0 111.988 177.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.12 -62.55 1.59 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 175.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 9.0 m -55.45 -54.17 47.19 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 62' ' ' ALA . 49.8 t -55.02 -62.98 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.365 0 C-N-CA 127.391 2.276 . . . . 0.0 109.733 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.432 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 2.7 m-30 -57.29 -42.14 81.13 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.78 -38.66 70.19 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.839 0.856 . . . . 0.0 112.448 170.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.0 -62.94 1.5 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.124 0.969 . . . . 0.0 109.9 165.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -177.96 168.71 2.03 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 127.993 2.517 . . . . 0.0 112.668 161.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 pt? . . . . . 0 C--O 1.252 1.227 0 C-N-CA 126.682 1.993 . . . . 0.0 111.958 164.078 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_exo . . . . . 0 N--CA 1.486 1.045 0 N-CA-C 112.745 0.248 . . . . 0.0 112.745 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.6 m -73.25 51.08 0.31 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.577 1.951 . . . . 0.0 114.944 -174.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -155.78 161.78 30.84 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 125.488 1.518 . . . . 0.0 112.486 176.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 49.5 tttt 43.01 -103.7 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.264 1.826 . . . . 0.0 111.771 -167.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -157.71 140.76 10.9 Favored Pre-proline 0 CA--C 1.55 0.954 0 C-N-CA 127.399 2.279 . . . . 0.0 107.847 166.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.7 -39.52 3.42 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 121.709 1.606 . . . . 0.0 114.01 -170.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.555 HG13 ' HG2' ' A' ' 55' ' ' LYS . 78.3 t -53.82 -54.96 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-O 122.351 1.072 . . . . 0.0 108.124 171.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 tpt -55.62 -50.38 70.31 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 126.274 1.83 . . . . 0.0 115.816 -176.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.256 9.6 pt -57.72 -51.15 73.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 120.768 1.622 . . . . 0.0 113.576 167.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.302 0.0 OUTLIER -55.57 -45.02 77.37 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.02 1.282 . . . . 0.0 114.094 179.459 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -55.32 -53.95 49.73 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 127.998 2.519 . . . . 0.0 112.685 170.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -55.51 -57.06 13.48 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.478 1.111 . . . . 0.0 113.153 173.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.39 -44.77 76.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.92 1.688 . . . . 0.0 114.769 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.8 mtm180 35.43 65.81 1.76 Allowed Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.245 1.818 . . . . 0.0 114.93 -168.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.53 78.53 0.18 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 123.317 2.678 . . . . 0.0 113.196 168.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 60.61 27.54 66.34 Favored Glycine 0 CA--C 1.535 1.317 0 C-N-CA 126.362 1.934 . . . . 0.0 115.992 171.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.4 pp -106.35 158.16 17.08 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 117.318 2.34 . . . . 0.0 117.318 -155.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.91 135.87 40.02 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 127.691 2.396 . . . . 0.0 113.608 168.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -104.59 135.4 46.06 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.293 1.037 . . . . 0.0 111.437 176.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -104.89 135.65 45.84 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.354 1.862 . . . . 0.0 109.186 164.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -104.64 130.8 52.61 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 122.764 1.268 . . . . 0.0 110.513 170.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.6 mp -128.54 151.28 49.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 129.741 3.216 . . . . 0.0 106.025 -172.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 33' ' ' PHE . 67.4 m -115.51 129.46 56.55 Favored 'General case' 0 C--N 1.318 -0.779 0 O-C-N 120.843 -1.16 . . . . 0.0 109.025 149.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -156.56 -61.17 0.1 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 118.163 -1.415 . . . . 0.0 113.132 -168.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 25.5 t -49.19 138.04 12.94 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.481 1.513 . . . . 0.0 111.297 -175.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 175.62 32.03 0.04 OUTLIER Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.465 1.031 . . . . 0.0 113.482 -162.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -132.23 -73.16 0.52 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.144 1.378 . . . . 0.0 112.213 -164.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.9 t -66.28 -24.74 66.61 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.507 1.123 . . . . 0.0 112.518 167.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -149.52 127.83 12.15 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 128.748 2.819 . . . . 0.0 108.037 -174.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.55 -27.99 69.01 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 116.911 2.189 . . . . 0.0 116.911 -156.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -156.71 126.83 6.43 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 119.129 0.877 . . . . 0.0 112.605 166.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -135.36 147.05 48.96 Favored 'General case' 0 C--O 1.248 1.0 0 C-N-CA 127.281 2.233 . . . . 0.0 112.924 169.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 0.1 OUTLIER -101.48 131.38 47.65 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 104.188 -2.523 . . . . 0.0 104.188 177.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 25.6 t -108.57 131.63 58.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.909 -160.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 6.7 mmt -104.7 124.23 49.01 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 169.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -120.16 134.79 55.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 175.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.4 135.81 51.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.503 -169.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.1 t -104.22 120.6 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 106.057 -1.831 . . . . 0.0 106.057 167.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 48.3 t -142.99 134.05 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 125.91 1.684 . . . . 0.0 108.863 -162.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.5 t70 56.66 -66.93 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 127.751 2.42 . . . . 0.0 113.854 -167.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.68 19.26 0.06 OUTLIER Glycine 0 CA--C 1.54 1.618 0 C-N-CA 128.576 2.989 . . . . 0.0 111.942 174.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -126.62 176.33 7.29 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.959 2.504 . . . . 0.0 109.252 -170.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -130.67 134.67 47.13 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.996 0.919 . . . . 0.0 111.901 -175.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -135.0 150.24 50.31 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.416 1.486 . . . . 0.0 111.177 -173.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.23 135.1 30.36 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.474 1.11 . . . . 0.0 111.019 -173.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.79 120.73 2.73 Favored Glycine 0 CA--C 1.523 0.556 0 C-N-CA 125.731 1.634 . . . . 0.0 111.048 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.9 p -104.96 104.69 14.48 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.421 1.088 . . . . 0.0 110.47 -176.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.56 135.72 8.03 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 115.044 0.778 . . . . 0.0 115.044 -166.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -62.27 -1.98 0.88 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 170.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -161.2 158.56 27.58 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.561 2.344 . . . . 0.0 108.963 169.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -55.56 -32.73 63.26 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 121.028 1.74 . . . . 0.0 114.943 170.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -5.32 5.19 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 121.629 2.013 . . . . 0.0 115.247 169.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.7 tp -117.85 -52.44 2.43 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.412 1.885 . . . . 0.0 110.53 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.3 -53.89 50.38 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.372 1.469 . . . . 0.0 112.501 173.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.555 ' HG2' HG13 ' A' ' 7' ' ' VAL . 4.3 ttmt -55.5 -47.79 75.65 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 117.462 -1.256 . . . . 0.0 112.294 168.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.5 -48.51 74.49 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 120.474 1.488 . . . . 0.0 112.529 -178.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.6 mmm-85 -54.96 -59.47 4.7 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 129.228 3.011 . . . . 0.0 113.291 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.42 -50.2 70.41 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.924 0.89 . . . . 0.0 112.457 176.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.93 -52.3 63.39 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 126.245 1.818 . . . . 0.0 112.8 172.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.4 mm100 -52.65 -50.47 63.15 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.941 1.696 . . . . 0.0 111.843 177.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.2 m -55.33 -55.08 35.66 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.646 1.178 . . . . 0.0 112.193 173.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.05 -61.12 2.52 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.871 1.268 . . . . 0.0 112.224 177.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -44.64 -60.12 2.15 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 127.791 2.436 . . . . 0.0 111.49 176.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.29 -53.25 56.35 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 117.886 0.312 . . . . 0.0 110.868 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 58.8 m -55.25 -73.83 0.05 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 175.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.264 4.9 m -55.66 -47.11 79.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 124.8 1.24 . . . . 0.0 114.081 -175.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 5.6 m-30 -57.15 -47.23 81.69 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 170.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.0 t30 -55.45 -38.37 68.94 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.665 1.12 . . . . 0.0 112.946 172.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.96 -60.63 3.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.001 1.32 . . . . 0.0 110.36 167.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -172.59 -43.48 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.181 1.792 . . . . 0.0 113.578 161.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 76.5 mt . . . . . 0 C--O 1.252 1.206 0 C-N-CA 127.817 2.447 . . . . 0.0 112.45 -167.527 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 CA--C 1.544 0.989 0 N-CA-C 112.524 0.163 . . . . 0.0 112.524 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.6 t -68.74 -49.65 57.09 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.548 1.939 . . . . 0.0 113.507 0.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 78.35 -1.03 72.63 Favored Glycine 0 CA--C 1.542 1.738 0 C-N-CA 124.522 1.058 . . . . 0.0 114.91 -172.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.8 pttt -152.21 146.03 25.13 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.259 2.224 . . . . 0.0 111.051 -174.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -66.52 152.29 95.06 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 124.583 1.153 . . . . 0.0 110.904 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.95 -36.53 38.21 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 121.564 1.509 . . . . 0.0 114.355 -171.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 13.3 t -55.1 -48.76 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -43.35 75.33 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.04 1.336 . . . . 0.0 114.525 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 17.5 mt -55.89 -61.06 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.744 1.218 . . . . 0.0 111.517 168.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.258 0.0 OUTLIER -55.27 -37.85 67.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.787 0.803 . . . . 0.0 112.806 -179.194 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -55.4 -56.98 13.9 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 126.954 2.102 . . . . 0.0 113.263 168.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -55.3 -53.33 57.53 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.95 2.1 . . . . 0.0 112.508 177.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.57 -40.95 72.62 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.588 2.755 . . . . 0.0 115.078 173.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.331 0.0 OUTLIER 5.42 80.81 0.04 OUTLIER Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 129.337 3.055 . . . . 0.0 118.055 -168.371 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.05 -175.83 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 124.311 3.341 . . . . 0.0 114.995 163.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.03 83.03 0.07 OUTLIER Glycine 0 CA--C 1.534 1.266 0 O-C-N 121.121 -0.987 . . . . 0.0 111.507 162.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.7 pp -130.32 160.7 33.14 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -175.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -135.7 135.78 40.34 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.826 2.05 . . . . 0.0 113.438 167.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -104.53 135.55 45.73 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.805 1.242 . . . . 0.0 110.668 174.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -125.99 135.73 52.16 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 126.91 2.084 . . . . 0.0 109.985 -178.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -104.63 131.47 52.02 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 122.509 1.147 . . . . 0.0 111.332 -172.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.8 mp -134.94 135.63 41.65 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 128.848 2.859 . . . . 0.0 107.342 -175.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 p -85.01 151.17 24.38 Favored 'General case' 0 C--N 1.319 -0.741 0 O-C-N 119.86 -1.775 . . . . 0.0 112.663 159.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.284 5.1 tp10 89.02 52.64 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 116.765 2.135 . . . . 0.0 116.765 142.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.413 ' HB2' HG21 ' A' ' 34' ' ' VAL . 27.7 t -72.72 50.04 0.24 Allowed 'General case' 0 N--CA 1.483 1.223 0 CA-C-O 122.782 1.277 . . . . 0.0 111.158 153.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.47 -177.05 1.32 Allowed Glycine 0 CA--C 1.53 1.02 0 C-N-CA 129.456 3.408 . . . . 0.0 120.559 175.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -120.53 -23.04 6.2 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 113.607 -1.297 . . . . 0.0 114.369 -151.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.1 m -63.03 -14.93 54.14 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 115.867 1.803 . . . . 0.0 115.867 -159.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 15.9 p80 -153.1 -37.68 0.1 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.439 1.496 . . . . 0.0 111.002 162.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.33 -52.0 11.86 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 -173.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? 47.53 88.78 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.358 1.463 . . . . 0.0 110.451 -156.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 54.5 m -104.36 135.29 46.08 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.619 0.723 . . . . 0.0 112.408 -156.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 7.8 m-30 -104.66 135.4 46.13 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 105.315 -2.106 . . . . 0.0 105.315 161.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.413 HG21 ' HB2' ' A' ' 25' ' ' SER . 56.0 t -122.57 115.79 47.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.99 0 CA-C-N 114.546 -1.206 . . . . 0.0 108.14 -157.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 82.1 mmm -104.9 117.34 33.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.834 176.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.1 p -104.88 135.52 46.09 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.778 177.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -135.12 135.55 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 121.673 -0.642 . . . . 0.0 110.207 -172.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.2 t -104.27 116.46 48.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 105.274 -2.121 . . . . 0.0 105.274 169.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 63.1 t -137.67 123.33 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 125.487 1.515 . . . . 0.0 108.46 -165.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.8 t70 63.88 -29.44 0.1 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 127.244 2.218 . . . . 0.0 116.2 -176.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 139.93 -5.81 2.82 Favored Glycine 0 CA--C 1.538 1.529 0 C-N-CA 125.555 1.55 . . . . 0.0 113.056 -161.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -104.95 167.92 9.39 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 127.101 2.161 . . . . 0.0 110.117 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -134.55 139.11 45.15 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.754 0.822 . . . . 0.0 112.227 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -135.04 158.99 42.93 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.435 1.494 . . . . 0.0 112.161 -176.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -135.45 121.67 20.27 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 126.23 1.812 . . . . 0.0 108.983 171.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -114.79 105.25 1.48 Allowed Glycine 0 CA--C 1.52 0.364 0 C-N-CA 126.013 1.768 . . . . 0.0 109.644 -176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.8 m -105.28 104.36 14.08 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.76 0.791 . . . . 0.0 110.126 -170.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.11 136.37 8.38 Favored Glycine 0 CA--C 1.531 1.044 0 C-N-CA 125.966 1.746 . . . . 0.0 114.36 -169.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 33.7 ttm180 -48.35 -26.72 2.17 Favored 'General case' 0 N--CA 1.482 1.125 0 N-CA-C 115.982 1.845 . . . . 0.0 115.982 179.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.487 ' HB3' ' HE2' ' A' ' 52' ' ' LYS . 20.3 t-20 -150.36 166.29 30.49 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 125.775 1.63 . . . . 0.0 111.072 169.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -46.61 -46.84 19.94 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-N 120.355 1.434 . . . . 0.0 114.407 -175.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.487 ' HE2' ' HB3' ' A' ' 50' ' ' ASN . 0.0 OUTLIER -58.47 -5.81 0.59 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 116.096 1.887 . . . . 0.0 116.096 175.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 32.6 tp -120.11 -42.89 2.56 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.296 2.238 . . . . 0.0 110.869 173.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.43 -59.57 4.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.089 1.356 . . . . 0.0 112.507 171.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -55.46 -39.83 70.85 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-O 115.455 -2.212 . . . . 0.0 112.984 164.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.28 -52.1 64.53 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 123.37 2.805 . . . . 0.0 111.907 178.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.23 -54.29 45.28 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.503 1.921 . . . . 0.0 114.078 169.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -58.37 8.05 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.88 0.872 . . . . 0.0 112.63 176.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.29 -51.93 13.63 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 125.034 1.334 . . . . 0.0 114.105 167.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.1 mt-30 -55.13 -51.37 66.64 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.226 1.41 . . . . 0.0 112.052 178.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.2 m -55.28 -53.06 60.82 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.705 1.202 . . . . 0.0 111.831 174.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.12 -61.7 2.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.229 175.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.59 -60.11 2.14 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 127.3 2.24 . . . . 0.0 110.97 178.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.05 -52.4 63.31 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.212 0.205 . . . . 0.0 111.495 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 82.0 m -55.36 -69.02 0.15 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 176.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.297 32.8 m -55.39 -47.13 78.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -176.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.2 m-30 -56.73 -38.53 72.5 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -55.93 -44.97 78.84 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 120.126 1.33 . . . . 0.0 111.659 171.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.257 3.5 pp -89.71 13.03 15.26 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 175.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.333 3.7 p80 71.73 36.18 1.27 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 128.245 2.618 . . . . 0.0 115.632 150.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.996 1.719 . . . . 0.0 113.375 167.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_exo . . . . . 0 CA--C 1.537 0.658 0 CA-C-O 121.388 0.495 . . . . 0.0 112.72 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t -115.89 23.65 12.09 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.786 2.034 . . . . 0.0 112.285 -164.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.61 44.42 0.11 Allowed Glycine 0 CA--C 1.538 1.488 0 N-CA-C 120.883 3.113 . . . . 0.0 120.883 -159.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -61.43 -25.61 67.33 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 119.925 1.863 . . . . 0.0 111.991 163.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -144.66 137.61 13.82 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 126.937 2.095 . . . . 0.0 107.629 163.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -61.61 -27.13 81.19 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.15 2.566 . . . . 0.0 114.752 -176.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.479 HG13 ' HG2' ' A' ' 55' ' ' LYS . 74.8 t -55.1 -48.06 76.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.464 0 CA-C-N 118.264 0.484 . . . . 0.0 109.729 176.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.47 -42.53 74.48 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.913 1.285 . . . . 0.0 114.112 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.425 ' H ' HG13 ' A' ' 9' ' ' ILE . 3.5 mt -55.98 -59.26 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.299 1.04 . . . . 0.0 113.091 167.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.27 0.0 OUTLIER -55.4 -37.5 67.67 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.348 0.659 . . . . 0.0 112.062 -179.308 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -55.35 -61.81 2.09 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 127.461 2.304 . . . . 0.0 112.67 164.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -55.52 -53.4 56.8 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.187 -0.945 . . . . 0.0 112.343 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.419 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 11.8 mt -56.92 -40.22 75.92 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 116.413 2.005 . . . . 0.0 116.413 171.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.42 0.0 OUTLIER 0.91 73.52 0.04 OUTLIER Pre-proline 0 N--CA 1.488 1.451 0 C-N-CA 127.831 2.452 . . . . 0.0 117.032 -160.619 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -74.08 64.06 5.15 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 124.346 3.364 . . . . 0.0 113.864 -173.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.08 27.34 73.72 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.739 1.161 . . . . 0.0 114.843 173.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 pp -91.66 167.82 11.93 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.749 1.619 . . . . 0.0 113.676 -171.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -135.22 136.47 41.77 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.456 1.502 . . . . 0.0 113.367 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -104.32 135.4 45.85 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.045 0.938 . . . . 0.0 110.827 179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -123.81 120.6 33.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.679 1.992 . . . . 0.0 109.158 177.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -104.95 131.56 52.3 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 124.551 1.14 . . . . 0.0 111.787 -167.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.38 168.48 18.51 Favored 'General case' 0 N--CA 1.438 -1.067 0 C-N-CA 126.669 1.988 . . . . 0.0 106.629 -179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 80.1 p -150.13 165.23 33.45 Favored 'General case' 0 C--N 1.311 -1.066 0 O-C-N 119.594 -1.941 . . . . 0.0 111.426 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.284 3.1 mp0 75.84 39.3 0.32 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.497 1.919 . . . . 0.0 113.015 177.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.3 t -62.26 -4.0 1.58 Allowed 'General case' 0 CA--C 1.553 1.091 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.798 152.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -169.04 161.13 34.77 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 127.262 2.363 . . . . 0.0 110.399 174.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -140.61 154.2 46.36 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.997 1.319 . . . . 0.0 111.027 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 29' ' ' HIS . 51.5 m 5.32 83.19 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 129.786 3.234 . . . . 0.0 115.464 163.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 28' ' ' SER . 66.4 m80 -112.39 6.39 18.68 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 128.994 2.918 . . . . 0.0 114.407 17.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.09 1.2 11.63 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.017 1.327 . . . . 0.0 113.889 171.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 48.4 tptt -27.85 104.27 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 128.833 2.853 . . . . 0.0 114.847 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 71.1 m -135.36 135.22 40.53 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.519 1.128 . . . . 0.0 112.661 -172.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -104.59 135.88 45.18 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 127.84 2.456 . . . . 0.0 107.868 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.8 p -121.49 129.29 75.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 CA-C-O 122.931 1.348 . . . . 0.0 114.507 -172.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.29 125.38 53.82 Favored 'General case' 0 CA--C 1.505 -0.758 0 O-C-N 120.678 -1.264 . . . . 0.0 110.154 -176.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.5 p -114.5 142.74 46.01 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 124.351 1.061 . . . . 0.0 111.708 177.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -135.18 135.94 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 O-C-N 120.891 -1.131 . . . . 0.0 110.973 -175.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.18 118.28 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 170.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 69.7 t -132.92 -33.87 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -158.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -137.59 13.35 2.97 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 122.221 1.01 . . . . 0.0 113.484 -160.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.29 -11.25 31.44 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 110.808 -0.917 . . . . 0.0 110.808 -153.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -105.15 164.29 11.93 Favored 'General case' 0 C--O 1.24 0.599 0 C-N-CA 128.219 2.608 . . . . 0.0 110.862 175.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -129.83 138.68 51.13 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 126.301 1.84 . . . . 0.0 109.811 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -132.51 152.94 51.39 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 125.658 1.583 . . . . 0.0 109.194 -174.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -140.68 135.27 31.47 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.236 1.014 . . . . 0.0 111.178 173.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -125.66 122.79 4.67 Favored Glycine 0 CA--C 1.523 0.566 0 C-N-CA 126.519 2.009 . . . . 0.0 111.284 178.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 t -104.91 119.69 39.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 123.78 0.832 . . . . 0.0 110.549 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.28 149.14 20.82 Favored Glycine 0 CA--C 1.531 1.063 0 C-N-CA 125.104 1.335 . . . . 0.0 116.06 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.9 mmt180 -48.98 -26.16 2.37 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.758 2.133 . . . . 0.0 116.758 175.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -161.15 -176.27 5.35 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 126.11 1.764 . . . . 0.0 108.78 152.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 28.5 mtmm -45.76 -38.66 7.27 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 126.943 2.097 . . . . 0.0 115.33 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -16.13 4.38 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.448 1.648 . . . . 0.0 115.448 173.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 31.4 tp -123.38 -40.41 2.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.149 2.18 . . . . 0.0 111.786 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.69 -57.64 11.15 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.103 1.361 . . . . 0.0 112.291 171.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.479 ' HG2' HG13 ' A' ' 7' ' ' VAL . 8.6 ttmt -55.14 -45.82 75.65 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-O 116.61 -1.662 . . . . 0.0 109.376 169.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.44 75.44 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 121.994 2.179 . . . . 0.0 113.441 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 -55.51 -57.82 10.31 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 123.815 0.846 . . . . 0.0 112.858 170.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.36 -52.27 64.07 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.082 0.953 . . . . 0.0 112.164 -179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.06 -58.37 6.76 Favored 'General case' 0 C--O 1.215 -0.723 0 C-N-CA 128.247 2.619 . . . . 0.0 111.978 173.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -55.04 -47.43 74.79 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 120.133 1.333 . . . . 0.0 111.158 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 11.7 m -55.29 -55.63 29.22 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.22 1.008 . . . . 0.0 112.141 175.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.2 -53.28 58.02 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.809 1.244 . . . . 0.0 112.839 173.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.87 -61.66 1.85 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 128.055 2.542 . . . . 0.0 110.325 176.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.31 -46.29 72.79 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 122.93 0.492 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.4 m -55.14 -75.45 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.552 0.741 . . . . 0.0 112.767 173.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.0 m -55.45 -40.0 56.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -176.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.419 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 4.7 m-30 -59.84 -43.76 94.44 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 120.711 -1.243 . . . . 0.0 113.959 172.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -35.37 65.92 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 120.258 1.39 . . . . 0.0 113.811 163.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 15.3 mt -71.2 -20.04 62.32 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 119.324 0.966 . . . . 0.0 113.334 170.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.253 10.9 m-70 76.82 44.0 0.12 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.598 2.759 . . . . 0.0 112.574 -178.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 C--O 1.247 0.959 0 C-N-CA 127.503 2.321 . . . . 0.0 111.276 178.676 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo . . . . . 0 CA--C 1.539 0.733 0 CA-C-O 121.823 0.676 . . . . 0.0 112.867 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.6 p -65.71 -24.48 66.99 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.531 1.932 . . . . 0.0 115.149 -175.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 165.35 -176.04 41.03 Favored Glycine 0 CA--C 1.533 1.162 0 C-N-CA 124.402 1.001 . . . . 0.0 114.092 175.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -70.17 -24.83 63.21 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.753 1.221 . . . . 0.0 113.481 175.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -56.76 119.36 29.17 Favored Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 124.916 1.286 . . . . 0.0 111.207 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -71.87 -36.86 5.62 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 121.964 1.776 . . . . 0.0 113.901 -173.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.506 HG22 ' HB3' ' A' ' 55' ' ' LYS . 93.5 t -52.76 -55.01 13.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-O 122.664 1.221 . . . . 0.0 108.88 173.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 9.2 tpt -55.79 -51.49 67.26 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 116.057 1.873 . . . . 0.0 116.057 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.254 10.4 pt -55.67 -47.71 78.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 166.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.283 0.0 OUTLIER -55.63 -43.1 75.85 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 174.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.08 -54.59 41.2 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.535 2.334 . . . . 0.0 112.031 172.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.53 -64.14 0.94 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.428 1.891 . . . . 0.0 112.739 175.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . 0.281 50.6 mt -56.08 -25.21 44.45 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 116.369 1.989 . . . . 0.0 116.369 175.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.308 0.0 OUTLIER 22.64 61.38 0.33 Allowed Pre-proline 0 N--CA 1.491 1.583 0 C-N-CA 129.038 2.935 . . . . 0.0 116.495 -178.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -72.44 39.59 0.42 Allowed 'Trans proline' 0 CA--C 1.555 1.56 1 C-N-CA 125.416 4.078 . . . . 0.0 117.169 -160.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 87.66 32.22 13.79 Favored Glycine 0 CA--C 1.534 1.256 0 O-C-N 120.266 -1.521 . . . . 0.0 113.737 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.31 171.58 7.29 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 115.713 1.746 . . . . 0.0 115.713 -169.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.5 ptmm? -135.33 140.25 44.94 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 127.621 2.369 . . . . 0.0 111.513 160.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.4 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 27.2 m-85 -104.42 135.43 45.88 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.415 1.086 . . . . 0.0 110.841 176.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -128.9 127.67 42.26 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.565 1.546 . . . . 0.0 109.409 176.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 81.8 t80 -105.35 131.24 53.04 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.506 1.122 . . . . 0.0 111.707 -170.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -133.23 170.16 15.84 Favored 'General case' 0 N--CA 1.44 -0.953 0 C-N-CA 127.917 2.487 . . . . 0.0 105.584 179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.6 t -147.59 169.83 18.79 Favored 'General case' 0 C--N 1.315 -0.934 0 O-C-N 119.533 -1.979 . . . . 0.0 110.56 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.255 16.3 mm-40 103.71 12.98 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 128.29 2.636 . . . . 0.0 113.094 161.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 45.8 t -55.98 170.87 0.28 Allowed 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 121.891 0.853 . . . . 0.0 110.745 152.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -167.06 37.82 0.24 Allowed Glycine 0 CA--C 1.532 1.144 0 C-N-CA 125.322 1.439 . . . . 0.0 111.886 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.51 -23.93 28.92 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 -168.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.9 t -142.68 2.77 1.42 Allowed 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.55 1.315 . . . . 0.0 114.55 174.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -157.4 167.86 29.02 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.813 -1.18 . . . . 0.0 112.282 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.18 -20.57 10.83 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.395 1.878 . . . . 0.0 115.91 -178.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.8 tppt? -147.86 141.59 25.65 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.84 1.052 . . . . 0.0 113.84 168.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 t -135.56 136.25 40.97 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 128.285 2.634 . . . . 0.0 111.072 171.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 8.7 m-30 -103.97 135.44 45.49 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 175.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 7.3 p -116.65 135.12 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 CA-C-O 123.775 1.75 . . . . 0.0 114.77 -169.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -115.89 130.36 56.8 Favored 'General case' 0 CA--C 1.51 -0.562 0 CA-C-N 114.738 -1.119 . . . . 0.0 110.267 -179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 59.9 p -119.31 135.64 54.62 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 124.06 0.944 . . . . 0.0 111.437 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.4 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 2.3 m -122.15 135.69 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.01 0.924 . . . . 0.0 111.534 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.7 t -104.39 127.1 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 165.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.8 p -148.32 148.68 15.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.429 1.491 . . . . 0.0 109.849 -178.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 t70 60.19 -66.4 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 127.452 2.301 . . . . 0.0 114.258 -176.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -173.01 19.14 0.06 OUTLIER Glycine 0 CA--C 1.541 1.713 0 C-N-CA 128.245 2.831 . . . . 0.0 112.396 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -135.27 167.37 21.14 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.576 2.35 . . . . 0.0 111.66 -168.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -134.95 136.73 42.47 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.627 1.171 . . . . 0.0 112.391 -165.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -135.09 153.92 51.86 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.898 1.679 . . . . 0.0 110.936 -175.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -137.95 135.17 35.77 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.857 1.263 . . . . 0.0 111.889 -178.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.69 106.6 0.63 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 127.368 2.413 . . . . 0.0 111.464 -172.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 p -104.74 114.55 28.83 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-N 118.695 1.247 . . . . 0.0 110.72 -177.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.97 143.23 14.65 Favored Glycine 0 CA--C 1.528 0.881 0 CA-C-N 114.412 -1.267 . . . . 0.0 115.562 -170.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.7 mmp_? -30.05 -53.47 0.16 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 125.573 1.549 . . . . 0.0 114.546 174.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -137.94 -175.59 4.14 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 124.81 1.244 . . . . 0.0 110.593 159.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.458 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 95.4 mttt -45.28 -43.66 10.73 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 125.185 1.394 . . . . 0.0 114.479 177.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.04 -17.17 2.39 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 115.835 1.791 . . . . 0.0 115.835 177.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.4 tp -115.41 -38.48 3.78 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.196 1.798 . . . . 0.0 111.254 174.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.458 ' HB3' ' HA ' ' A' ' 51' ' ' LYS . . . -55.47 -54.62 41.6 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.514 1.126 . . . . 0.0 112.079 173.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.506 ' HB3' HG22 ' A' ' 7' ' ' VAL . 15.3 mmtt -55.19 -44.05 74.96 Favored 'General case' 0 C--O 1.204 -1.32 0 CA-C-O 114.91 -2.472 . . . . 0.0 112.457 162.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.33 -47.69 75.28 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 124.324 3.238 . . . . 0.0 111.474 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -55.39 -62.85 1.4 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.452 1.901 . . . . 0.0 112.728 171.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.1 -55.72 27.88 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.262 1.425 . . . . 0.0 112.559 179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -42.37 -63.92 0.68 Allowed 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 125.592 1.557 . . . . 0.0 114.21 165.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.17 -45.32 75.76 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 120.832 1.651 . . . . 0.0 111.606 -176.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.7 m -55.23 -57.73 10.58 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.307 0.643 . . . . 0.0 112.296 175.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.489 ' O ' HG22 ' A' ' 66' ' ' VAL . . . -55.18 -50.87 68.24 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.287 1.035 . . . . 0.0 112.503 175.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -60.56 3.12 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 126.51 1.924 . . . . 0.0 111.164 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.39 -47.59 69.39 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.076 0.398 . . . . 0.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 37.6 m -55.35 -71.19 0.09 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 173.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.489 HG22 ' O ' ' A' ' 62' ' ' ALA . 18.9 m -55.22 -39.93 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-N 119.281 0.946 . . . . 0.0 113.43 -177.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -56.32 -46.01 80.07 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 120.845 -1.159 . . . . 0.0 113.993 170.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.71 -34.97 65.59 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 165.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 20.1 mt -69.76 -29.23 66.52 Favored 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 119.296 0.953 . . . . 0.0 112.73 170.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.291 17.6 m-70 92.46 37.85 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 130.583 3.553 . . . . 0.0 114.008 175.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 N--CA 1.482 1.147 0 C-N-CA 125.181 1.392 . . . . 0.0 114.488 171.256 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo . . . . . 0 CA--C 1.542 0.898 0 N-CA-C 112.432 0.128 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 88.3 p -149.17 28.35 0.82 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 127.852 2.461 . . . . 0.0 113.286 1.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 82.69 -90.02 1.51 Allowed Glycine 0 CA--C 1.527 0.795 0 C-N-CA 124.859 1.219 . . . . 0.0 113.419 178.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 58.7 -24.63 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 127.973 2.509 . . . . 0.0 115.206 -164.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -139.56 155.73 71.62 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 127.473 2.309 . . . . 0.0 109.605 167.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -66.34 -37.21 24.64 Favored 'Trans proline' 0 C--N 1.347 0.49 0 C-N-CA 122.7 2.267 . . . . 0.0 115.161 -175.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.5 t -52.08 -49.69 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.085 0.554 . . . . 0.0 109.616 178.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -55.56 -51.81 65.85 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 179.223 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.411 ' H ' HG13 ' A' ' 9' ' ' ILE . 5.0 mt -55.75 -51.19 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 119.643 1.11 . . . . 0.0 111.884 174.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.86 -51.44 63.61 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.561 1.144 . . . . 0.0 109.876 176.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -55.73 -52.37 64.16 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.127 1.771 . . . . 0.0 112.444 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.1 tt0 -55.35 -60.08 3.9 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.044 2.138 . . . . 0.0 113.58 176.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.4 mt -55.89 -39.33 71.42 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 30.97 65.6 0.93 Allowed Pre-proline 0 N--CA 1.487 1.404 0 C-N-CA 128.048 2.539 . . . . 0.0 115.495 -177.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_exo -64.59 -34.05 53.59 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.144 2.563 . . . . 0.0 114.435 -167.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.99 25.05 0.07 OUTLIER Glycine 0 CA--C 1.536 1.396 0 C-N-CA 125.693 1.616 . . . . 0.0 113.335 177.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.446 ' CD2' HG22 ' A' ' 39' ' ' VAL . 37.3 mt -58.92 136.27 57.82 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 126.58 1.952 . . . . 0.0 114.866 -165.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -135.08 135.93 41.63 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.629 1.572 . . . . 0.0 110.363 147.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.405 ' CD2' ' CG1' ' A' ' 37' ' ' VAL . 20.1 m-85 -104.67 135.28 46.36 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.664 1.228 . . . . 0.0 110.735 -178.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -120.68 135.59 55.08 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 128.017 2.527 . . . . 0.0 109.101 -177.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -104.79 126.05 51.47 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 122.831 1.3 . . . . 0.0 111.618 -175.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -132.64 145.84 51.4 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 130.928 3.691 . . . . 0.0 105.631 -176.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.1 t -131.07 67.29 1.52 Allowed 'General case' 0 N--CA 1.475 0.818 0 O-C-N 119.399 -2.063 . . . . 0.0 110.344 -172.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -139.43 -52.25 0.54 Allowed 'General case' 0 N--CA 1.477 0.878 0 O-C-N 120.337 -1.477 . . . . 0.0 114.336 -129.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 29.4 t -69.04 -178.72 1.31 Allowed 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.665 1.186 . . . . 0.0 111.183 170.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.02 169.71 42.42 Favored Glycine 0 CA--C 1.528 0.863 0 O-C-N 120.821 -1.175 . . . . 0.0 114.981 174.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -145.8 149.98 35.34 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.996 2.118 . . . . 0.0 107.312 168.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.9 m -41.77 -9.31 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 131.27 3.828 . . . . 0.0 121.21 -150.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -147.42 74.94 1.34 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.774 1.63 . . . . 0.0 110.53 169.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -150.07 -4.92 0.35 Allowed 'General case' 0 CA--C 1.558 1.284 0 O-C-N 117.707 -3.121 . . . . 0.0 114.504 -1.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -150.59 152.35 33.95 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.934 1.294 . . . . 0.0 113.182 -163.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.8 m -135.06 135.5 41.32 Favored 'General case' 0 C--O 1.241 0.616 0 C-N-CA 127.98 2.512 . . . . 0.0 109.788 171.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 21.4 m-30 -95.48 130.71 42.21 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 104.192 -2.521 . . . . 0.0 104.192 -178.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 55.7 t -108.58 116.38 51.6 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 113.493 -1.685 . . . . 0.0 107.406 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 11.8 mmt -104.71 123.8 48.25 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 175.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.5 m -123.13 135.06 54.19 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.405 ' CG1' ' CD2' ' A' ' 19' ' ' TYR . 1.8 m -127.91 135.43 62.97 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.054 0.942 . . . . 0.0 111.989 -169.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.7 t -104.36 125.26 59.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 167.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.446 HG22 ' CD2' ' A' ' 17' ' ' LEU . 94.3 t -135.36 -33.86 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -158.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -149.21 26.48 0.87 Allowed 'General case' 0 CA--C 1.547 0.864 0 CA-C-O 122.408 1.099 . . . . 0.0 111.566 -160.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.23 -15.44 8.9 Favored Glycine 0 CA--C 1.538 1.474 0 O-C-N 120.797 -1.189 . . . . 0.0 112.873 -161.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -112.1 168.76 9.35 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.769 2.027 . . . . 0.0 112.252 175.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -133.48 140.23 47.13 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 126.585 1.954 . . . . 0.0 111.106 -163.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -134.97 155.25 51.07 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.945 1.698 . . . . 0.0 110.762 -175.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -132.74 135.08 45.52 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 124.285 1.034 . . . . 0.0 110.581 -176.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.01 109.24 0.85 Allowed Glycine 0 CA--C 1.525 0.678 0 C-N-CA 125.106 1.336 . . . . 0.0 112.522 -166.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.7 p -104.78 104.63 14.45 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 118.019 0.909 . . . . 0.0 112.245 -168.363 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.17 135.93 7.62 Favored Glycine 0 CA--C 1.526 0.737 0 N-CA-C 116.139 1.215 . . . . 0.0 116.139 -176.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -50.46 -23.8 2.69 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 116.712 2.116 . . . . 0.0 116.712 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -149.34 176.94 10.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.268 1.027 . . . . 0.0 110.831 157.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.1 mtmt -47.11 -48.35 22.99 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 125.897 1.679 . . . . 0.0 114.444 -174.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.23 -9.41 0.65 Allowed 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 176.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.8 tp -117.56 -41.73 2.92 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.808 2.043 . . . . 0.0 110.798 172.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.63 -59.52 4.73 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.647 1.579 . . . . 0.0 113.036 173.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -55.46 -41.58 73.12 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-O 115.667 -2.111 . . . . 0.0 112.532 164.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.26 -48.97 73.22 Favored 'General case' 0 C--O 1.219 -0.552 0 CA-C-N 122.719 2.508 . . . . 0.0 111.19 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -55.32 -58.82 6.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.728 2.011 . . . . 0.0 115.343 163.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.38 -53.71 52.86 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 119.766 1.166 . . . . 0.0 111.889 -176.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -40.58 -72.84 0.06 Allowed 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 117.525 -1.226 . . . . 0.0 113.634 156.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -45.27 -46.32 12.56 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.175 1.807 . . . . 0.0 113.796 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.4 m -55.27 -63.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.881 1.272 . . . . 0.0 112.895 170.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.34 -59.58 4.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.078 0.951 . . . . 0.0 112.81 178.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.8 tp -45.27 -63.34 0.96 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 129.779 3.231 . . . . 0.0 111.226 178.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.21 -45.02 75.9 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 175.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 85.5 m -55.33 -68.46 0.19 Allowed 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 118.583 0.629 . . . . 0.0 112.359 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.4 m -55.29 -35.32 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.409 1.004 . . . . 0.0 113.125 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.0 m-30 -63.73 -40.56 97.03 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 120.616 -1.303 . . . . 0.0 114.115 175.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -55.41 -39.32 70.07 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 118.926 0.785 . . . . 0.0 112.503 162.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 12.0 mt -76.84 1.27 17.92 Favored 'General case' 0 N--CA 1.483 1.213 0 N-CA-C 115.452 1.649 . . . . 0.0 115.452 170.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.279 0.9 OUTLIER 70.73 24.09 4.37 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.296 1.838 . . . . 0.0 113.993 157.576 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.7 mt . . . . . 0 C--O 1.252 1.235 0 C-N-CA 127.842 2.457 . . . . 0.0 112.725 -176.12 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo . . . . . 0 CA--C 1.544 0.979 0 N-CA-C 113.189 0.419 . . . . 0.0 113.189 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.7 m -64.95 -12.97 55.71 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 129.338 3.055 . . . . 0.0 115.455 4.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -148.78 -164.28 11.41 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 125.806 1.67 . . . . 0.0 112.364 174.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.4 pttt -143.48 -44.46 0.28 Allowed 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 126.699 2.0 . . . . 0.0 110.588 177.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -147.02 143.53 18.44 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 127.388 2.275 . . . . 0.0 106.192 145.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -72.9 -30.79 10.81 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 CA-C-N 121.158 1.449 . . . . 0.0 114.962 -171.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.676 HG13 ' HG2' ' A' ' 55' ' ' LYS . 15.2 t -55.44 -52.98 40.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.666 1.121 . . . . 0.0 109.287 160.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.9 ttt -55.49 -48.93 73.81 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -176.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.4 pt -60.13 -49.68 83.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 119.586 1.085 . . . . 0.0 111.805 169.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.348 0.0 OUTLIER -55.94 -39.37 71.6 Favored 'General case' 0 N--CA 1.461 0.094 0 N-CA-C 117.062 2.245 . . . . 0.0 117.062 177.666 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 17.7 t30 -55.54 -60.2 3.76 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.619 1.968 . . . . 0.0 109.426 169.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -55.2 -59.2 5.11 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.438 1.495 . . . . 0.0 113.999 179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.6 mt -55.73 -45.27 78.0 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.157 1.783 . . . . 0.0 115.619 171.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptp85 34.83 65.85 1.58 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 127.051 2.14 . . . . 0.0 115.3 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.64 33.91 0.09 OUTLIER 'Trans proline' 0 CA--C 1.557 1.659 1 C-N-CA 125.814 4.342 . . . . 0.0 118.452 -175.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.54 10.93 85.36 Favored Glycine 0 CA--C 1.539 1.587 0 O-C-N 119.762 -1.836 . . . . 0.0 114.351 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.22 164.0 4.53 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.304 2.241 . . . . 0.0 115.337 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.07 139.49 44.79 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.79 2.036 . . . . 0.0 111.818 164.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -104.56 135.37 46.09 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.276 1.03 . . . . 0.0 112.376 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -118.71 135.17 54.63 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.498 2.319 . . . . 0.0 109.241 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -112.37 129.23 56.38 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 122.315 1.055 . . . . 0.0 112.146 -174.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.74 150.99 51.49 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 129.75 3.22 . . . . 0.0 108.392 -171.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.6 p -118.62 126.93 53.03 Favored 'General case' 0 C--N 1.316 -0.862 0 C-N-CA 126.777 2.031 . . . . 0.0 113.977 -169.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.358 0.8 OUTLIER 69.61 43.82 0.95 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 123.515 1.626 . . . . 0.0 114.749 147.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.459 ' CB ' HG21 ' A' ' 34' ' ' VAL . 7.4 t -70.15 -2.15 12.19 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 129.292 3.037 . . . . 0.0 115.794 175.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.67 25.26 4.49 Favored Glycine 0 N--CA 1.472 1.079 0 N-CA-C 116.718 1.447 . . . . 0.0 116.718 -151.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -63.89 -23.34 67.31 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-N 119.894 1.847 . . . . 0.0 113.555 -177.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.6 p -68.83 -16.45 63.78 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.504 1.922 . . . . 0.0 114.385 170.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 11.5 p80 -153.28 51.11 0.72 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.791 2.036 . . . . 0.0 110.587 -175.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.406 ' HA ' ' HA ' ' A' ' 31' ' ' LYS . . . -38.33 118.37 0.71 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.682 1.993 . . . . 0.0 114.039 -165.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 30' ' ' ALA . 4.1 mmtm -128.06 165.54 20.14 Favored 'General case' 0 N--CA 1.479 0.995 1 C-N-CA 132.387 4.275 . . . . 0.0 110.702 10.735 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.9 m -135.26 106.68 6.83 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 164.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -87.5 136.85 32.78 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 102.654 -3.091 . . . . 0.0 102.654 156.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.459 HG21 ' CB ' ' A' ' 25' ' ' SER . 19.1 t -124.1 130.03 73.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 123.197 1.475 . . . . 0.0 109.302 -157.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.5 mmm -118.29 135.34 54.35 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 113.52 -1.673 . . . . 0.0 108.799 -179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.5 m -125.19 135.46 52.62 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.508 0.723 . . . . 0.0 110.197 176.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.6 m -117.86 135.92 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 124.251 1.021 . . . . 0.0 111.992 178.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.5 t -104.2 126.74 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 164.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.7 p -151.66 149.0 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.693 1.197 . . . . 0.0 110.347 -178.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 11.4 t70 55.8 -69.85 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 127.32 2.248 . . . . 0.0 114.112 -168.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.02 21.88 0.08 OUTLIER Glycine 0 CA--C 1.537 1.451 0 C-N-CA 128.396 2.903 . . . . 0.0 111.794 173.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -128.55 162.43 27.27 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 127.441 2.296 . . . . 0.0 109.878 -167.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 91.2 t80 -132.81 133.66 43.66 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.95 1.3 . . . . 0.0 111.626 -173.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -135.11 141.5 46.03 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.608 1.163 . . . . 0.0 110.741 -175.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.8 mp0 -118.16 135.04 54.48 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.337 1.855 . . . . 0.0 109.976 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -133.82 132.7 6.55 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.625 1.107 . . . . 0.0 112.556 -176.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -128.03 104.65 7.9 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.748 0.785 . . . . 0.0 111.719 -164.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.96 140.56 11.68 Favored Glycine 0 CA--C 1.533 1.196 0 C-N-CA 125.49 1.519 . . . . 0.0 115.161 -163.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -47.37 -27.68 1.74 Allowed 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 116.074 1.879 . . . . 0.0 116.074 175.727 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -154.97 174.75 14.72 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 126.639 1.976 . . . . 0.0 109.498 162.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 68.3 mttt -53.11 -31.78 43.89 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 127.393 2.277 . . . . 0.0 115.982 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -13.9 7.78 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 121.226 1.83 . . . . 0.0 115.127 167.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -115.35 -50.79 2.72 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.209 2.204 . . . . 0.0 110.264 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.45 -52.56 63.19 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 120.377 -1.452 . . . . 0.0 112.962 176.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.676 ' HG2' HG13 ' A' ' 7' ' ' VAL . 4.9 ttmt -55.14 -48.41 73.73 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-O 117.23 -1.367 . . . . 0.0 109.444 169.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -54.98 -49.06 72.37 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 120.561 1.528 . . . . 0.0 113.675 -179.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -55.31 -60.95 2.69 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.574 1.149 . . . . 0.0 112.178 172.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.34 -50.87 68.51 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.252 1.021 . . . . 0.0 112.207 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -51.67 -66.98 0.29 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 126.517 1.927 . . . . 0.0 111.904 171.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -55.45 -38.49 69.12 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.257 0.935 . . . . 0.0 112.942 -174.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 t -55.33 -59.72 4.41 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.872 0.869 . . . . 0.0 113.167 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.14 -56.39 20.43 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.122 1.369 . . . . 0.0 112.672 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.404 ' HG ' ' CZ ' ' A' ' 67' ' ' PHE . 0.6 OUTLIER -43.54 -61.49 1.37 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 111.458 172.622 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.24 -49.25 67.22 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.809 0.731 . . . . 0.0 111.165 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 35.9 m -55.29 -73.38 0.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 173.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.273 34.0 m -55.51 -44.39 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.404 ' CZ ' ' HG ' ' A' ' 63' ' ' LEU . 7.6 m-30 -56.38 -48.88 75.97 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 171.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -55.86 -37.06 68.26 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 120.212 1.369 . . . . 0.0 113.696 169.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.39 -39.62 91.36 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 124.582 1.153 . . . . 0.0 111.655 168.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.295 20.4 m-70 98.08 44.72 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 131.062 3.745 . . . . 0.0 112.538 177.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.25 1.094 0 C-N-CA 127.187 2.195 . . . . 0.0 110.87 178.68 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo . . . . . 0 N--CA 1.489 1.241 0 CA-C-O 119.028 -0.488 . . . . 0.0 112.816 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.1 p -140.92 -58.63 0.51 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.649 1.18 . . . . 0.0 112.963 -173.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -65.44 -16.61 63.16 Favored Glycine 0 CA--C 1.54 1.609 0 C-N-CA 124.997 1.284 . . . . 0.0 113.827 168.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -132.52 95.13 3.55 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 127.556 2.342 . . . . 0.0 108.369 166.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -153.4 132.3 6.85 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.522 1.529 . . . . 0.0 109.124 -175.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.49 -36.11 27.61 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 121.474 1.449 . . . . 0.0 113.54 -174.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.573 HG13 ' HG2' ' A' ' 55' ' ' LYS . 78.5 t -53.87 -51.76 41.95 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 174.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.03 -49.13 72.33 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -177.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 13.3 mt -55.64 -58.18 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 124.218 1.007 . . . . 0.0 111.371 174.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.439 ' HB2' HD13 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -55.06 -46.36 75.37 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.453 1.101 . . . . 0.0 111.635 179.793 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -55.56 -57.29 12.54 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 126.271 1.828 . . . . 0.0 112.427 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -55.85 -53.16 60.08 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.708 1.603 . . . . 0.0 113.174 175.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.46 -34.97 64.98 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.069 1.348 . . . . 0.0 113.488 177.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 35.8 54.11 2.22 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 127.161 2.184 . . . . 0.0 115.245 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -73.21 58.53 3.6 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 124.71 3.607 . . . . 0.0 115.227 -167.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.42 17.89 78.0 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.513 1.53 . . . . 0.0 114.84 177.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -81.62 174.1 11.72 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 115.389 1.625 . . . . 0.0 115.389 -172.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -134.97 143.06 46.65 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 127.127 2.171 . . . . 0.0 110.309 157.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -104.32 129.64 52.19 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 124.664 1.228 . . . . 0.0 109.584 172.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -110.72 135.18 51.71 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 127.69 2.396 . . . . 0.0 108.482 177.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -109.77 125.63 52.9 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 123.144 1.45 . . . . 0.0 111.701 -176.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.4 mp -135.09 157.09 47.82 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 131.319 3.847 . . . . 0.0 105.826 -173.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.3 m -149.66 102.09 3.13 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 119.317 -2.114 . . . . 0.0 110.144 169.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -164.45 -18.12 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 120.385 3.476 . . . . 0.0 120.385 -174.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.6 m -72.45 34.56 0.07 Allowed 'General case' 0 N--CA 1.482 1.173 0 N-CA-C 116.064 1.875 . . . . 0.0 116.064 -169.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 176.43 27.42 0.03 OUTLIER Glycine 0 N--CA 1.472 1.076 0 N-CA-C 118.319 2.088 . . . . 0.0 118.319 -173.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -60.55 -34.95 74.9 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.185 1.993 . . . . 0.0 114.333 -173.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.9 t -72.0 -6.45 42.29 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.884 1.274 . . . . 0.0 113.594 176.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -143.76 52.37 1.32 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.197 2.199 . . . . 0.0 109.551 175.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.0 141.18 6.19 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.24 1.816 . . . . 0.0 115.512 -161.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.5 tptt -135.82 137.24 41.35 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 129.888 3.275 . . . . 0.0 110.819 4.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.7 m -104.76 125.79 51.19 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 122.453 1.12 . . . . 0.0 111.116 175.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -104.35 133.45 49.23 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 104.604 -2.369 . . . . 0.0 104.604 174.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 70.1 t -118.65 117.74 55.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 123.046 1.403 . . . . 0.0 110.561 -168.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 71.2 mmm -105.33 126.06 51.68 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.733 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.7 m -116.71 135.5 53.72 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 123.652 0.781 . . . . 0.0 110.125 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 m -119.48 135.91 58.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.954 0.902 . . . . 0.0 111.702 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 87.8 t -104.11 127.79 58.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 N-CA-C 105.758 -1.941 . . . . 0.0 105.758 160.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.1 p -148.85 146.93 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 125.825 1.65 . . . . 0.0 109.321 -174.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.6 t70 59.07 -67.22 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 126.944 2.098 . . . . 0.0 114.668 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -171.23 19.47 0.07 OUTLIER Glycine 0 CA--C 1.541 1.719 0 C-N-CA 128.528 2.966 . . . . 0.0 112.798 169.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -135.12 165.04 26.3 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.721 2.408 . . . . 0.0 111.667 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -133.92 137.39 44.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.538 1.135 . . . . 0.0 112.779 -167.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -135.13 157.48 46.82 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.428 1.491 . . . . 0.0 111.812 -175.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -132.83 133.83 43.87 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.557 1.943 . . . . 0.0 109.268 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -131.4 113.54 1.38 Allowed Glycine 0 N--CA 1.468 0.792 0 C-N-CA 125.036 1.303 . . . . 0.0 112.089 -175.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 33.5 p -104.99 108.96 20.75 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.289 1.035 . . . . 0.0 112.122 -173.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.65 143.49 15.05 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.927 1.727 . . . . 0.0 114.466 -173.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -17.85 1.47 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 177.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -161.5 179.51 8.17 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 126.499 1.92 . . . . 0.0 110.308 153.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -45.45 -40.45 8.3 Favored 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.357 1.863 . . . . 0.0 115.766 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.01 -16.96 5.62 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 174.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 27.8 tp -118.33 -44.24 2.68 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.886 2.074 . . . . 0.0 111.378 176.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.46 -53.26 58.53 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.582 -1.324 . . . . 0.0 112.77 175.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.573 ' HG2' HG13 ' A' ' 7' ' ' VAL . 8.2 ttmt -55.24 -46.25 76.04 Favored 'General case' 0 C--O 1.211 -0.964 0 CA-C-O 116.53 -1.7 . . . . 0.0 110.967 166.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.44 -48.05 75.06 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 121.972 2.169 . . . . 0.0 112.578 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.6 mmm180 -55.48 -60.25 3.69 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 126.522 1.929 . . . . 0.0 112.163 173.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.24 -50.66 68.89 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 124.428 1.091 . . . . 0.0 112.322 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -49.5 -59.64 3.57 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.239 1.816 . . . . 0.0 111.618 170.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.77 -48.35 72.77 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 120.104 1.32 . . . . 0.0 110.691 -176.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -55.36 -60.33 3.55 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 173.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.37 -61.55 2.26 Favored 'General case' 0 C--O 1.226 -0.146 0 C-N-CA 126.493 1.917 . . . . 0.0 112.307 178.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.439 HD13 ' HB2' ' A' ' 10' ' ' LEU . 11.7 tp -53.29 -53.26 53.46 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 127.647 2.379 . . . . 0.0 111.922 -177.539 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.33 74.42 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.052 0.842 . . . . 0.0 112.802 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 95.6 m -55.28 -62.55 1.6 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.6 0.76 . . . . 0.0 112.984 175.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 22.6 m -55.58 -46.29 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 177.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.95 -47.45 77.58 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.641 1.349 . . . . 0.0 114.641 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.83 -38.93 70.69 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.719 1.208 . . . . 0.0 114.248 169.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -39.19 89.88 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.993 1.317 . . . . 0.0 111.803 167.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.313 25.2 m-70 99.77 39.79 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 131.178 3.791 . . . . 0.0 113.297 176.252 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.7 mt . . . . . 0 N--CA 1.481 1.077 0 C-N-CA 126.93 2.092 . . . . 0.0 113.168 173.718 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo . . . . . 0 CA--C 1.541 0.838 0 N-CA-C 113.176 0.414 . . . . 0.0 113.176 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.2 m 47.73 30.94 1.98 Allowed 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 116.62 2.082 . . . . 0.0 116.62 166.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 143.22 -25.35 2.2 Favored Glycine 0 CA--C 1.534 1.265 0 C-N-CA 124.95 1.262 . . . . 0.0 113.951 -177.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 83.1 mttt -134.78 120.83 19.88 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.057 1.343 . . . . 0.0 111.614 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -58.99 145.1 81.02 Favored Pre-proline 0 CA--C 1.553 1.077 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 156.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -59.12 -33.54 98.42 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.599 2.199 . . . . 0.0 115.12 -178.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.502 HG13 ' HG2' ' A' ' 55' ' ' LYS . 42.6 t -55.18 -44.77 76.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.818 0 CA-C-N 118.85 0.75 . . . . 0.0 110.548 168.372 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.32 -42.64 74.02 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.854 -1.154 . . . . 0.0 113.019 177.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 8.6 mt -60.22 -57.39 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.648 1.179 . . . . 0.0 110.684 173.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.315 0.0 OUTLIER -55.84 -38.9 70.68 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 115.645 1.721 . . . . 0.0 115.645 176.291 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 42.6 t30 -56.13 -52.86 62.83 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 124.848 1.259 . . . . 0.0 111.559 171.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -55.26 -65.62 0.55 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.705 1.602 . . . . 0.0 113.175 173.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.8 mt -55.57 -43.41 75.88 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.636 1.574 . . . . 0.0 115.234 176.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.263 7.7 ptm85 30.24 66.89 0.79 Allowed Pre-proline 0 N--CA 1.481 1.098 0 C-N-CA 128.299 2.64 . . . . 0.0 115.246 -176.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -61.02 20.17 0.04 OUTLIER 'Trans proline' 0 CA--C 1.552 1.392 1 C-N-CA 125.777 4.318 . . . . 0.0 118.348 -175.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.19 30.36 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.123 1.345 . . . . 0.0 113.698 -175.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.2 pp -88.7 159.67 17.71 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.985 1.106 . . . . 0.0 113.985 -176.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.46 138.42 43.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 126.212 1.805 . . . . 0.0 112.493 -179.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -104.67 135.13 46.64 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 122.431 1.11 . . . . 0.0 112.85 -171.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -105.28 135.32 46.86 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.018 2.527 . . . . 0.0 108.843 167.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -108.35 121.11 44.23 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 122.114 0.959 . . . . 0.0 110.958 175.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.6 155.97 43.02 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 129.453 3.101 . . . . 0.0 107.123 -175.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.7 t -114.93 161.19 18.62 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 120.451 -1.405 . . . . 0.0 110.857 160.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.301 19.7 mm-40 95.7 82.53 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 127.163 2.185 . . . . 0.0 115.72 164.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.7 t -128.74 53.07 1.88 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.809 1.644 . . . . 0.0 110.285 161.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -162.67 -158.89 9.94 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 125.087 1.327 . . . . 0.0 113.083 -170.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -73.38 170.01 15.96 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 119.148 -2.384 . . . . 0.0 114.012 4.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 11.2 t -144.48 -151.28 0.36 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.561 1.944 . . . . 0.0 108.926 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -52.59 -18.82 1.92 Allowed 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.735 1.614 . . . . 0.0 114.03 163.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -148.98 173.98 12.77 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.583 2.353 . . . . 0.0 110.733 173.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.4 tppt? -61.75 152.35 31.47 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.821 1.248 . . . . 0.0 111.066 164.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.6 m -117.24 125.14 50.66 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.215 1.406 . . . . 0.0 110.599 169.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-30 -104.71 135.74 45.54 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 105.915 -1.884 . . . . 0.0 105.915 170.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 78.3 t -112.84 117.5 55.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 122.038 0.923 . . . . 0.0 109.208 -169.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 78.9 mmm -104.77 135.04 46.9 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 173.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.2 m -132.81 135.47 45.69 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 122.47 0.308 . . . . 0.0 111.055 -176.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.9 m -120.11 135.51 60.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 124.303 1.041 . . . . 0.0 112.191 -173.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.6 t -104.47 120.11 54.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 167.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 78.2 t -125.04 -45.44 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -157.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -148.27 29.98 0.86 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 122.669 1.223 . . . . 0.0 111.066 -162.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.94 -12.71 22.47 Favored Glycine 0 CA--C 1.538 1.491 0 O-C-N 120.532 -1.355 . . . . 0.0 112.963 -162.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -109.96 161.78 15.16 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 126.688 1.995 . . . . 0.0 111.735 174.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -134.85 137.96 43.75 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 126.039 1.736 . . . . 0.0 111.389 -162.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 25.8 m-85 -134.97 149.94 50.29 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 125.373 1.469 . . . . 0.0 111.088 -175.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -132.9 135.04 45.34 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.274 1.43 . . . . 0.0 110.399 -174.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.83 117.41 1.75 Allowed Glycine 0 CA--C 1.523 0.557 0 C-N-CA 125.238 1.399 . . . . 0.0 112.707 -167.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 p -106.64 104.73 14.49 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.736 1.214 . . . . 0.0 112.26 -169.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.85 147.73 19.33 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.633 1.587 . . . . 0.0 114.795 -173.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -44.24 -39.32 4.37 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 115.073 1.509 . . . . 0.0 115.073 176.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -155.2 177.42 11.36 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 125.777 1.631 . . . . 0.0 110.333 165.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -45.23 -41.39 8.37 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 127.422 2.289 . . . . 0.0 116.159 -174.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.5 -13.87 1.74 Allowed 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 173.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 34.5 tp -125.98 -42.71 1.87 Allowed 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.439 2.295 . . . . 0.0 111.505 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.57 -54.72 40.49 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.443 -1.411 . . . . 0.0 112.333 172.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.502 ' HG2' HG13 ' A' ' 7' ' ' VAL . 11.2 ttmt -55.41 -39.77 70.62 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-O 117.419 -1.277 . . . . 0.0 111.932 168.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.39 -54.83 38.82 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.576 1.535 . . . . 0.0 111.667 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.6 mmp_? -54.99 -52.79 62.02 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 126.638 1.975 . . . . 0.0 113.661 171.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.54 -52.62 63.11 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.622 0.769 . . . . 0.0 112.126 177.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.18 -53.65 47.51 Favored 'General case' 0 C--O 1.213 -0.868 0 C-N-CA 125.854 1.662 . . . . 0.0 112.202 171.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -52.49 -50.4 62.81 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.634 1.574 . . . . 0.0 111.876 -179.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.8 t -55.3 -56.45 19.91 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 124.093 0.957 . . . . 0.0 113.034 171.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.18 -61.45 2.32 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.771 1.229 . . . . 0.0 112.718 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.44 ' HG ' ' CE2' ' A' ' 67' ' ' PHE . 0.4 OUTLIER -46.23 -57.78 4.25 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 128.566 2.746 . . . . 0.0 111.5 176.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.89 -49.88 70.14 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.528 0.604 . . . . 0.0 111.103 179.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 50.2 m -55.24 -73.97 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 173.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.288 18.3 m -55.72 -44.62 77.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 N-CA-C 114.861 1.43 . . . . 0.0 114.861 -175.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.44 ' CE2' ' HG ' ' A' ' 63' ' ' LEU . 6.6 m-30 -60.06 -44.54 94.65 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 120.652 -1.28 . . . . 0.0 114.149 172.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.83 -37.6 68.9 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 120.384 1.447 . . . . 0.0 114.439 168.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.49 -40.06 89.96 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.851 1.26 . . . . 0.0 111.594 167.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.303 23.6 m-70 100.53 42.99 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 130.923 3.689 . . . . 0.0 112.784 176.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.7 tp . . . . . 0 C--O 1.249 1.056 0 C-N-CA 126.157 1.783 . . . . 0.0 111.374 172.788 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo . . . . . 0 CA--C 1.539 0.764 0 N-CA-C 113.63 0.589 . . . . 0.0 113.63 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 t 55.52 -165.69 0.11 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.811 1.644 . . . . 0.0 113.545 -176.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -171.49 -166.32 30.07 Favored Glycine 0 CA--C 1.54 1.626 0 N-CA-C 117.214 1.646 . . . . 0.0 117.214 -172.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -143.83 3.27 1.24 Allowed 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 116.84 2.163 . . . . 0.0 116.84 13.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -56.34 101.63 0.27 Allowed Pre-proline 0 N--CA 1.48 1.062 0 CA-C-N 120.424 1.465 . . . . 0.0 110.7 174.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -78.94 -45.4 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.441 0 CA-C-N 121.004 1.394 . . . . 0.0 114.942 -141.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.535 HG22 ' HB3' ' A' ' 55' ' ' LYS . 90.0 t -55.04 -52.9 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 173.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -55.45 -54.77 39.68 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 127.154 2.181 . . . . 0.0 115.558 -178.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.276 1.7 pt -59.95 -50.38 80.34 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-O 118.115 -0.945 . . . . 0.0 113.085 172.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . 0.307 0.0 OUTLIER -55.52 -46.24 77.05 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 120.462 1.483 . . . . 0.0 113.521 178.692 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -46.96 -63.07 1.13 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 127.247 2.219 . . . . 0.0 111.809 168.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.5 tp10 -56.28 -47.02 79.45 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 115.778 1.77 . . . . 0.0 115.778 176.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.5 mt -55.67 -29.16 58.86 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.909 1.283 . . . . 0.0 114.342 171.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 35.36 60.41 2.62 Favored Pre-proline 0 N--CA 1.486 1.362 0 C-N-CA 126.782 2.033 . . . . 0.0 116.238 174.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -59.42 21.78 0.03 OUTLIER 'Trans proline' 0 CA--C 1.56 1.786 0 C-N-CA 125.244 3.963 . . . . 0.0 119.58 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 71.23 24.72 76.69 Favored Glycine 0 CA--C 1.536 1.391 0 O-C-N 119.856 -1.777 . . . . 0.0 112.775 -167.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.42 171.96 7.89 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 126.918 2.087 . . . . 0.0 115.032 -172.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.35 135.25 40.58 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.091 1.357 . . . . 0.0 111.942 158.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -104.68 135.63 45.71 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.235 1.414 . . . . 0.0 110.549 173.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -130.31 135.16 47.78 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.418 1.487 . . . . 0.0 109.906 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -107.98 128.56 54.76 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.578 1.18 . . . . 0.0 112.214 -168.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.8 151.49 52.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 129.839 3.256 . . . . 0.0 106.702 -172.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p -133.07 104.19 6.4 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 119.933 -1.73 . . . . 0.0 110.127 161.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -159.51 -12.07 0.06 Allowed 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 120.098 3.37 . . . . 0.0 120.098 -171.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 31.1 t -76.13 29.61 0.12 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 121.183 1.811 . . . . 0.0 113.813 -177.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -171.22 13.64 0.05 OUTLIER Glycine 0 N--CA 1.469 0.845 0 C-N-CA 124.872 1.225 . . . . 0.0 115.253 -174.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -51.32 -40.27 58.69 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 114.905 1.446 . . . . 0.0 114.905 -157.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.7 m -81.86 -9.53 59.58 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -175.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -152.25 -26.59 0.17 Allowed 'General case' 0 N--CA 1.48 1.062 0 N-CA-C 117.293 2.331 . . . . 0.0 117.293 -165.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -144.05 -9.58 0.68 Allowed 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 -172.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 52.7 tptt 38.59 84.87 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.47 2.308 . . . . 0.0 113.327 -176.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.7 m -104.34 135.74 45.23 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.167 0.987 . . . . 0.0 109.526 -166.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -96.41 122.11 38.95 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 -164.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 93.4 t -109.89 124.24 66.45 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 114.021 -1.445 . . . . 0.0 109.89 -169.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 63.1 mmm -104.86 124.36 49.31 Favored 'General case' 0 CA--C 1.509 -0.604 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 172.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.3 p -111.38 134.02 53.27 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.513 175.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -135.64 135.58 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.469 0.708 . . . . 0.0 111.571 -173.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.9 t -104.47 119.79 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 106.646 -1.612 . . . . 0.0 106.646 166.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.7 m -133.65 -3.03 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 -160.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -155.43 -20.11 0.11 Allowed 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 114.52 1.304 . . . . 0.0 114.52 -174.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 110.31 -18.33 28.06 Favored Glycine 0 CA--C 1.538 1.48 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -142.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -105.0 162.17 13.58 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 125.701 1.6 . . . . 0.0 110.841 170.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -133.68 140.05 46.81 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.254 1.822 . . . . 0.0 110.925 -174.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -135.03 159.56 41.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 125.103 1.361 . . . . 0.0 111.532 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -135.6 134.66 39.54 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.361 1.864 . . . . 0.0 109.411 176.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.1 120.71 2.83 Favored Glycine 0 CA--C 1.523 0.551 0 C-N-CA 125.158 1.361 . . . . 0.0 111.338 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.4 p -105.01 110.47 22.88 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.648 1.179 . . . . 0.0 111.708 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.47 155.75 22.35 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.867 1.698 . . . . 0.0 114.465 -168.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -55.06 -38.74 68.41 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.801 -0.823 . . . . 0.0 113.148 174.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -151.17 -177.44 6.04 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 125.794 1.638 . . . . 0.0 109.193 159.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.5 mtmm -44.22 -35.04 2.08 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 127.683 2.393 . . . . 0.0 115.082 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 52.2 pttt -46.34 -29.91 1.87 Allowed 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 168.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 26.5 tp -121.3 -40.7 2.56 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.193 2.197 . . . . 0.0 111.319 -177.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.55 -52.03 65.08 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.904 1.282 . . . . 0.0 112.664 173.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.535 ' HB3' HG22 ' A' ' 7' ' ' VAL . 5.4 ttmt -55.38 -47.93 75.07 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 117.398 -1.286 . . . . 0.0 110.866 166.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.36 -48.8 73.7 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 120.471 1.487 . . . . 0.0 112.686 -176.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 33.4 mmm-85 -55.03 -59.77 4.3 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 128.885 2.874 . . . . 0.0 113.305 169.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.48 -49.42 72.57 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 121.594 0.712 . . . . 0.0 112.506 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.98 -51.49 66.04 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 126.646 1.978 . . . . 0.0 112.111 171.3 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -54.94 -47.6 74.25 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.409 1.484 . . . . 0.0 111.904 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.1 m -55.33 -54.97 36.9 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.577 1.151 . . . . 0.0 112.774 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.1 -57.94 9.71 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.88 1.272 . . . . 0.0 112.327 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.98 -55.06 13.05 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 128.371 2.668 . . . . 0.0 111.61 176.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.11 68.5 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.504 0.593 . . . . 0.0 110.92 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 27.1 m -55.47 -74.67 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 172.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 31.1 m -55.56 -37.28 45.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 114.654 1.353 . . . . 0.0 114.654 -177.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . 0.26 4.8 m-30 -68.47 -33.61 74.48 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 171.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -55.51 -35.26 65.41 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 120.152 -1.592 . . . . 0.0 113.156 159.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 21.5 mt -65.44 -47.34 76.53 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 118.248 -0.882 . . . . 0.0 112.429 169.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -158.09 138.38 12.58 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 151.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.6 tt . . . . . 0 C--O 1.251 1.155 0 C-N-CA 128.674 2.789 . . . . 0.0 114.712 -168.539 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo . . . . . 0 N--CA 1.486 1.055 0 N-CA-C 113.863 0.678 . . . . 0.0 113.863 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.4 m -54.5 161.87 1.31 Allowed 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.551 1.941 . . . . 0.0 114.297 176.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 111.55 21.29 6.55 Favored Glycine 0 CA--C 1.538 1.481 0 N-CA-C 115.453 0.941 . . . . 0.0 115.453 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 mtmm -137.85 -173.41 3.5 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.323 1.849 . . . . 0.0 110.418 -178.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -46.5 133.4 7.88 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.399 1.08 . . . . 0.0 111.417 172.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.14 -35.69 8.37 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 121.047 1.165 . . . . 0.0 113.786 -168.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.602 HG13 ' HG2' ' A' ' 55' ' ' LYS . 97.0 t -54.99 -53.24 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 171.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -55.55 -55.47 31.59 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . 0.271 7.3 pt -58.42 -47.48 87.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-N 120.735 1.607 . . . . 0.0 114.399 174.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.418 HD12 ' HA ' ' A' ' 7' ' ' VAL 0.275 0.0 OUTLIER -55.58 -46.65 77.22 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.481 0.919 . . . . 0.0 113.481 174.676 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -55.2 -54.69 40.16 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.464 1.905 . . . . 0.0 112.324 173.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -55.4 -61.1 2.56 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.548 1.939 . . . . 0.0 113.259 175.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.432 HD12 ' CZ ' ' A' ' 67' ' ' PHE . 8.3 mt -55.62 -34.91 65.32 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 175.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.1 tpp180 36.76 58.57 3.64 Favored Pre-proline 0 CA--C 1.553 1.082 0 C-N-CA 127.127 2.171 . . . . 0.0 114.598 -176.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -68.62 65.61 1.2 Allowed 'Trans proline' 0 CA--C 1.551 1.366 0 C-N-CA 124.52 3.48 . . . . 0.0 115.253 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 65.58 29.48 75.26 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 125.787 1.661 . . . . 0.0 114.835 172.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.3 pp -105.21 166.27 10.52 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 -163.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.31 145.63 47.67 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.733 2.013 . . . . 0.0 111.886 166.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -104.56 128.92 52.66 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.686 0.795 . . . . 0.0 110.471 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -104.89 134.34 48.18 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.227 1.811 . . . . 0.0 109.258 171.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.445 ' CE1' ' HE3' ' A' ' 51' ' ' LYS . 62.9 t80 -113.17 126.11 55.08 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 122.784 1.278 . . . . 0.0 110.969 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.93 154.92 47.6 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 130.065 3.346 . . . . 0.0 106.024 -173.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.5 t -133.94 116.5 15.65 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 119.577 -1.952 . . . . 0.0 110.133 164.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -154.62 -50.86 0.09 Allowed 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -143.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.4 m -79.82 179.86 7.32 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.921 1.688 . . . . 0.0 112.382 -178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.07 -32.15 4.27 Favored Glycine 0 N--CA 1.476 1.328 0 N-CA-C 117.964 1.946 . . . . 0.0 117.964 148.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.23 -3.71 0.29 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.512 1.925 . . . . 0.0 115.959 -169.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.0 p -41.72 -31.6 0.31 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.101 1.36 . . . . 0.0 114.565 151.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -150.67 -47.06 0.12 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.948 1.699 . . . . 0.0 112.418 176.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -167.34 154.1 8.35 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.409 1.884 . . . . 0.0 110.589 178.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -46.32 133.53 9.53 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 124.627 1.171 . . . . 0.0 113.114 -176.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.3 m -123.04 139.48 54.04 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 127.054 2.141 . . . . 0.0 111.64 -177.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.3 m-30 -99.07 134.28 42.13 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 104.862 -2.273 . . . . 0.0 104.862 -170.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 22.4 t -112.99 127.21 70.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 123.287 1.518 . . . . 0.0 110.22 -170.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.75 135.12 46.72 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 113.961 -1.472 . . . . 0.0 107.571 171.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.7 m -122.67 135.31 54.55 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 122.739 0.416 . . . . 0.0 110.582 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.3 m -108.88 135.78 46.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 O-C-N 121.555 -0.716 . . . . 0.0 111.529 172.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.8 t -101.09 122.07 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 160.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 7.4 p -146.97 142.75 20.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 127.015 2.126 . . . . 0.0 108.881 -167.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 8.8 t70 58.32 -67.04 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.428 1.891 . . . . 0.0 114.172 -174.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -170.11 17.97 0.07 OUTLIER Glycine 0 CA--C 1.541 1.706 0 C-N-CA 128.539 2.971 . . . . 0.0 112.827 169.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -134.96 165.81 24.48 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 127.767 2.427 . . . . 0.0 111.73 -168.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -134.86 128.61 32.98 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.467 1.107 . . . . 0.0 112.222 -162.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -134.37 136.59 43.48 Favored 'General case' 0 C--O 1.206 -1.218 0 C-N-CA 124.923 1.289 . . . . 0.0 111.956 -173.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -104.44 134.51 47.52 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 126.719 2.008 . . . . 0.0 109.85 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.69 112.67 1.16 Allowed Glycine 0 CA--C 1.52 0.367 0 C-N-CA 124.796 1.189 . . . . 0.0 112.202 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.2 p -104.8 117.18 33.43 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 123.671 0.788 . . . . 0.0 111.867 -172.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.52 146.49 18.5 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 125.158 1.361 . . . . 0.0 115.489 -166.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -46.42 -36.04 6.13 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 168.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -157.52 178.18 10.58 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.792 2.037 . . . . 0.0 109.066 162.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.445 ' HE3' ' CE1' ' A' ' 21' ' ' PHE . 82.0 mttt -46.44 -36.4 6.54 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 126.676 1.99 . . . . 0.0 115.162 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -16.14 2.42 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 171.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 29.3 tp -123.31 -43.29 2.2 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 126.7 2.0 . . . . 0.0 110.724 177.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.5 -52.43 63.7 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.554 -1.341 . . . . 0.0 112.279 175.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.602 ' HG2' HG13 ' A' ' 7' ' ' VAL . 5.4 ttmt -55.41 -47.28 76.16 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-O 117.529 -1.224 . . . . 0.0 110.677 169.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.49 -47.68 75.8 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 120.273 1.397 . . . . 0.0 112.615 -179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -55.48 -59.66 4.51 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.738 2.015 . . . . 0.0 112.03 173.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.35 -49.84 71.21 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.39 1.076 . . . . 0.0 112.092 177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -53.23 -58.62 6.43 Favored 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 126.344 1.858 . . . . 0.0 112.406 173.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -55.31 -44.86 76.17 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.442 1.474 . . . . 0.0 111.689 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.6 m -55.26 -55.31 32.88 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.87 0.868 . . . . 0.0 112.505 173.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.24 -56.24 22.26 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.739 1.215 . . . . 0.0 112.329 174.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -47.41 -56.87 6.08 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 128.047 2.539 . . . . 0.0 111.183 176.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.15 -52.69 60.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 118.298 0.499 . . . . 0.0 110.762 177.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 25.3 m -55.6 -71.2 0.09 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 175.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.289 24.7 m -55.26 -51.32 56.98 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 O-C-N 121.058 -1.026 . . . . 0.0 112.587 179.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.432 ' CZ ' HD12 ' A' ' 13' ' ' LEU . 5.9 m-30 -55.79 -33.93 64.84 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 121.366 1.894 . . . . 0.0 114.777 174.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -55.72 -38.12 69.32 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 162.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 13.9 mt -57.23 -48.95 77.54 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 162.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -165.11 175.13 9.64 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 115.795 1.776 . . . . 0.0 115.795 -153.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.8 mt . . . . . 0 C--O 1.255 1.35 0 C-N-CA 125.916 1.686 . . . . 0.0 111.323 159.237 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 N--CA 1.489 1.222 0 N-CA-C 111.976 -0.048 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.1 t -154.98 142.76 19.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.672 1.189 . . . . 0.0 111.48 176.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 166.56 -60.17 0.23 Allowed Glycine 0 CA--C 1.528 0.896 0 O-C-N 119.269 -2.144 . . . . 0.0 114.075 -7.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.9 tmtt? -57.74 -44.87 86.35 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.141 0.976 . . . . 0.0 113.003 178.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -56.03 -49.69 91.61 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-O 116.885 -1.531 . . . . 0.0 114.973 -171.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -64.7 -39.71 25.57 Favored 'Trans proline' 0 C--N 1.35 0.612 0 CA-C-N 122.383 1.887 . . . . 0.0 113.825 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 6.7 t -54.24 -50.93 52.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 171.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -55.71 28.44 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -176.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 7.0 pt -55.58 -49.2 75.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.821 1.191 . . . . 0.0 113.671 172.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.445 ' HA ' HD13 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -54.56 -51.26 65.81 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-N 119.51 1.05 . . . . 0.0 112.047 177.131 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -55.63 -54.01 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.207 1.803 . . . . 0.0 112.72 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -59.99 -45.03 94.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -39.56 71.33 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.963 1.305 . . . . 0.0 113.359 171.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 30.85 61.11 1.05 Allowed Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 127.826 2.45 . . . . 0.0 116.241 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -53.63 -38.83 84.49 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.513 2.142 . . . . 0.0 114.918 -174.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -173.36 33.92 0.12 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.411 1.481 . . . . 0.0 112.258 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.446 HD13 ' CE1' ' A' ' 19' ' ' TYR . 1.4 pp -77.61 151.58 34.31 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 117.046 2.239 . . . . 0.0 117.046 -154.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 135.8 40.24 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 127.203 2.201 . . . . 0.0 112.606 157.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.635 ' CD2' ' HE3' ' A' ' 55' ' ' LYS . 65.3 m-85 -104.86 135.58 45.95 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.822 1.249 . . . . 0.0 112.913 -177.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -108.12 135.73 48.98 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 128.664 2.785 . . . . 0.0 110.91 173.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -104.97 126.57 52.17 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.558 1.143 . . . . 0.0 111.452 171.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.7 mp -135.05 144.28 47.18 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 129.475 3.11 . . . . 0.0 106.903 -173.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.4 p -74.54 176.12 7.16 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 119.31 -2.119 . . . . 0.0 111.293 149.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . 0.308 8.2 tp10 134.51 -5.49 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 115.717 1.747 . . . . 0.0 115.717 119.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 34.5 t -61.11 153.67 25.07 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.081 -1.012 . . . . 0.0 110.879 164.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -153.12 163.01 30.41 Favored Glycine 0 CA--C 1.532 1.123 0 O-C-N 121.431 -0.793 . . . . 0.0 112.959 179.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -136.09 44.02 2.48 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.772 1.229 . . . . 0.0 111.102 -152.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 38.3 p 64.34 -31.76 0.12 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 129.254 3.022 . . . . 0.0 116.731 -175.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -148.25 12.98 0.96 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 125.512 1.525 . . . . 0.0 112.97 178.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -146.91 171.5 15.13 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.303 1.441 . . . . 0.0 111.252 176.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -130.31 147.71 52.05 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.109 1.363 . . . . 0.0 112.541 -175.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -127.56 146.8 50.4 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 128.05 2.54 . . . . 0.0 111.568 -171.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 2.1 m-30 -104.14 135.01 46.43 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 104.146 -2.539 . . . . 0.0 104.146 -179.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 79.7 t -112.98 116.55 52.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 123.103 1.43 . . . . 0.0 109.063 -161.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' MET . . . . . . . . . . . . . 22.8 mmt -105.14 122.94 46.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.478 -1.237 . . . . 0.0 107.859 177.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 41.2 m -128.5 135.24 49.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -172.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 2.2 t -135.03 135.44 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 O-C-N 120.839 -1.163 . . . . 0.0 109.724 -163.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.7 t -104.1 104.73 17.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 103.061 -2.941 . . . . 0.0 103.061 168.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.8 p -100.84 -12.39 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -152.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -167.72 -37.38 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 127.258 2.223 . . . . 0.0 111.643 -158.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 150.78 -25.06 1.04 Allowed Glycine 0 CA--C 1.538 1.515 0 C-N-CA 125.872 1.701 . . . . 0.0 110.72 -161.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -105.85 163.0 13.07 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 125.26 1.424 . . . . 0.0 110.372 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -125.81 138.67 53.85 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.71 1.604 . . . . 0.0 112.079 -168.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 -135.11 157.67 46.34 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 126.166 1.786 . . . . 0.0 111.844 -172.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -139.54 133.48 30.86 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.442 1.497 . . . . 0.0 110.384 -179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -134.96 119.58 2.17 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.471 1.51 . . . . 0.0 112.305 -173.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 29.2 p -105.24 104.96 14.79 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.409 1.084 . . . . 0.0 112.413 -171.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -135.87 138.03 9.6 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 125.115 1.34 . . . . 0.0 115.766 -176.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 ttm-85 -57.66 -12.92 3.24 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 116.786 2.143 . . . . 0.0 116.786 179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -155.5 177.85 10.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.527 1.131 . . . . 0.0 111.231 155.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -49.75 -51.76 36.6 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 124.834 1.253 . . . . 0.0 113.818 -171.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -6.76 0.44 Allowed 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 177.299 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 28.3 tp -115.26 -44.74 2.98 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.712 1.605 . . . . 0.0 110.308 171.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.56 -59.2 5.16 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.876 1.271 . . . . 0.0 113.086 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.635 ' HE3' ' CD2' ' A' ' 19' ' ' TYR . 18.8 mmtm -55.45 -37.81 68.21 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 115.288 -2.291 . . . . 0.0 112.581 164.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.72 -54.67 41.43 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 123.355 2.798 . . . . 0.0 111.492 178.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -55.33 -55.43 31.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 129.089 2.956 . . . . 0.0 113.749 170.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -55.41 -56.62 17.99 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.427 1.091 . . . . 0.0 111.462 177.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.42 ' CB ' ' HG ' ' A' ' 10' ' ' LEU . . . -44.97 -62.04 1.39 Allowed 'General case' 0 C--O 1.215 -0.749 0 C-N-CA 124.084 0.953 . . . . 0.0 113.161 166.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -47.53 -53.19 15.07 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.413 1.485 . . . . 0.0 112.015 -179.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 25.1 p -55.4 -57.57 11.33 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.12 1.155 . . . . 0.0 114.12 173.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -55.32 -64.25 0.9 Allowed 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 126.635 1.974 . . . . 0.0 112.014 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.445 HD13 ' HA ' ' A' ' 10' ' ' LEU . 11.9 tp -50.43 -54.45 21.91 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.677 2.791 . . . . 0.0 111.988 -179.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.17 -49.39 71.98 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 118.504 0.593 . . . . 0.0 112.388 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 86.3 m -55.43 -60.99 2.64 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 175.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 4.8 m -55.26 -47.56 77.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 119.275 0.943 . . . . 0.0 112.707 177.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.5 m-30 -55.85 -47.05 77.97 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 14.1 t30 -55.49 -39.72 70.79 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.732 1.213 . . . . 0.0 112.541 172.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -63.15 1.34 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.813 1.245 . . . . 0.0 110.374 166.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -170.79 164.51 7.94 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.163 1.785 . . . . 0.0 113.466 155.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.146 0 C-N-CA 126.958 2.103 . . . . 0.0 109.842 170.772 . . . . . . . . 1 1 . 1 stop_ save_