data_2lt5_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 2lt5 _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 ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 CA--C 1.539 0.744 0 N-CA-C 113.07 0.373 . . . . 0.0 113.07 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.26 178.21 7.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.417 1.887 . . . . 0.0 110.391 -176.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -105.64 126.81 52.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.641 1.177 . . . . 0.0 110.28 -178.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -133.48 155.99 48.56 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.874 1.27 . . . . 0.0 111.694 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -100.67 153.63 19.27 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.865 1.666 . . . . 0.0 112.302 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.37 112.48 19.37 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.702 1.601 . . . . 0.0 111.788 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -132.34 119.54 20.86 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.851 1.66 . . . . 0.0 110.936 174.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -132.08 150.2 52.22 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.516 1.526 . . . . 0.0 110.895 171.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.9 t -149.93 174.92 12.15 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.163 1.385 . . . . 0.0 111.705 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -141.18 104.03 4.55 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.417 -0.802 . . . . 0.0 111.004 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -165.91 173.16 10.8 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.947 1.299 . . . . 0.0 113.038 -172.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.7 173.2 2.94 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.856 2.063 . . . . 0.0 113.427 169.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -143.15 155.88 44.66 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.402 1.881 . . . . 0.0 110.422 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.9 t -113.62 145.94 40.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.237 1.415 . . . . 0.0 111.778 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -148.67 -179.3 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 126.314 1.845 . . . . 0.0 111.774 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.9 m -124.85 119.15 28.02 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.273 1.429 . . . . 0.0 111.893 174.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.5 t -85.44 131.15 34.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.508 1.123 . . . . 0.0 111.5 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -139.53 112.53 8.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.489 1.116 . . . . 0.0 109.303 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 58.66 58.22 3.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.33 1.452 . . . . 0.0 112.421 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.44 25.55 13.35 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.583 2.353 . . . . 0.0 114.83 169.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.46 134.91 5.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.093 1.357 . . . . 0.0 109.701 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.29 111.06 3.19 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.696 2.931 . . . . 0.0 113.705 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.3 m -109.85 16.09 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 126.35 1.86 . . . . 0.0 112.761 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -152.64 137.01 16.67 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.712 -1.242 . . . . 0.0 110.621 177.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -79.72 152.41 29.89 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 168.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.1 t -126.67 -47.53 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.594 0.758 . . . . 0.0 112.824 174.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.45 -174.69 46.89 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.474 1.034 . . . . 0.0 115.103 -175.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 41.3 t -125.75 121.25 59.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 109.799 -174.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 63.74 4.39 10.17 Favored Glycine 0 CA--C 1.542 1.768 0 N-CA-C 115.981 1.152 . . . . 0.0 115.981 -175.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -168.32 163.98 12.95 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.747 2.419 . . . . 0.0 110.54 -177.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.7 m . . . . . 0 CA--C 1.543 0.688 0 C-N-CA 126.05 1.74 . . . . 0.0 111.129 173.729 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 CA--C 1.542 0.665 0 CA-C-O 121.981 0.896 . . . . 0.0 109.64 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.5 t-105 -55.59 -37.22 67.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.826 1.65 . . . . 0.0 111.274 167.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -26.24 63.52 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.212 1.805 . . . . 0.0 113.123 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.8 p -107.8 -24.55 11.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.653 1.581 . . . . 0.0 113.815 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -50.19 -42.29 50.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.476 1.91 . . . . 0.0 112.666 171.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -56.22 -63.03 1.32 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.698 1.199 . . . . 0.0 110.785 173.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -58.87 -27.02 64.78 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -62.36 -54.12 45.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.667 1.187 . . . . 0.0 113.141 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.8 p80 -147.75 22.64 1.13 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -176.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -124.8 150.03 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.532 -1.355 . . . . 0.0 109.446 175.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.7 t -145.19 150.73 37.26 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -84.08 -1.14 54.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.572 1.549 . . . . 0.0 112.92 168.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -162.43 108.2 1.22 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.271 1.829 . . . . 0.0 111.312 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -68.35 108.84 3.38 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.219 -1.55 . . . . 0.0 110.806 172.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -114.45 5.78 15.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.646 1.578 . . . . 0.0 112.569 171.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -74.5 136.09 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.258 1.423 . . . . 0.0 111.562 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -125.56 3.83 7.59 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.054 1.741 . . . . 0.0 113.147 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 21.6 m 56.83 30.96 18.72 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.151 2.18 . . . . 0.0 114.651 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -146.09 -19.03 0.45 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.334 2.654 . . . . 0.0 112.929 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.31 -2.59 16.64 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.793 1.637 . . . . 0.0 113.478 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.5 pt -65.36 -4.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 125.505 1.522 . . . . 0.0 114.021 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 23.4 ptm -54.22 -28.01 38.21 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.524 1.129 . . . . 0.0 113.665 159.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.5 t -87.69 -26.94 22.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.444 1.497 . . . . 0.0 113.458 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.7 p -87.94 -178.55 6.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.866 1.266 . . . . 0.0 111.934 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -65.47 -16.0 63.21 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.932 -1.105 . . . . 0.0 113.634 176.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -90.75 19.07 5.75 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.485 1.914 . . . . 0.0 113.929 -173.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -67.47 -7.84 28.75 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.025 2.13 . . . . 0.0 114.348 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -61.99 -0.87 0.55 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 128.239 2.616 . . . . 0.0 115.882 -173.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 t 49.57 51.63 16.06 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.112 1.765 . . . . 0.0 113.182 -176.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 167.35 2.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.896 1.278 . . . . 0.0 112.52 170.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -76.78 -30.03 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.833 1.253 . . . . 0.0 112.622 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.31 169.32 17.64 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.711 2.004 . . . . 0.0 111.325 168.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -143.95 161.86 37.64 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.045 0.938 . . . . 0.0 110.396 159.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.6 m -124.01 92.3 3.64 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.153 1.381 . . . . 0.0 110.247 -177.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -78.6 121.51 24.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.248 1.019 . . . . 0.0 111.262 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.3 mt -94.43 116.05 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 124.759 1.224 . . . . 0.0 107.962 171.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -86.64 90.77 8.37 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.662 -0.649 . . . . 0.0 109.83 167.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 57.7 p -145.52 170.72 15.84 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.132 1.373 . . . . 0.0 112.494 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -78.25 163.46 61.97 Favored Pre-proline 0 N--CA 1.475 0.792 0 C-N-CA 124.367 1.067 . . . . 0.0 109.951 164.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.68 -24.44 18.42 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.167 1.912 . . . . 0.0 113.987 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.85 -55.39 46.16 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.328 -177.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.32 -1.73 8.61 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.097 2.531 . . . . 0.0 114.844 179.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 t -99.01 -54.69 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 126.212 1.805 . . . . 0.0 109.54 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.22 -45.59 80.18 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.766 0.827 . . . . 0.0 112.887 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.26 -3.72 38.05 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -171.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.0 mt -54.36 -35.46 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 123.456 0.703 . . . . 0.0 110.507 171.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 p -109.32 158.34 17.98 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.761 1.224 . . . . 0.0 113.17 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -155.92 108.44 2.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.941 1.696 . . . . 0.0 110.561 177.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.01 1.48 86.71 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 124.533 1.063 . . . . 0.0 114.977 -178.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -75.1 119.88 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.932 1.293 . . . . 0.0 111.298 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.16 -13.05 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 126.624 1.97 . . . . 0.0 110.993 173.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.86 3.68 4.97 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 127.428 2.291 . . . . 0.0 116.46 -168.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 54.08 64.55 1.79 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.469 1.507 . . . . 0.0 112.601 -172.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -158.66 152.04 22.91 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.601 1.96 . . . . 0.0 110.486 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -136.63 -169.32 2.43 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.906 -1.121 . . . . 0.0 110.835 163.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.3 p -122.71 150.82 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 125.314 1.446 . . . . 0.0 109.185 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.3 tp -50.91 138.91 18.18 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.841 0.856 . . . . 0.0 111.255 167.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.45 176.06 0.68 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.053 0.941 . . . . 0.0 111.679 173.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -117.65 -26.99 6.4 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.788 -1.195 . . . . 0.0 113.936 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -87.9 169.32 12.12 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.394 1.477 . . . . 0.0 112.38 -174.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -114.3 103.53 11.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.051 -1.031 . . . . 0.0 111.667 -174.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -98.96 158.42 15.66 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.172 1.789 . . . . 0.0 110.422 -176.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.93 106.54 3.68 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.763 -0.586 . . . . 0.0 110.549 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -95.56 123.2 38.99 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.202 1.001 . . . . 0.0 111.662 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.6 t -123.19 88.51 2.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.903 1.681 . . . . 0.0 110.927 -174.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -81.19 162.64 23.52 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.785 0.802 . . . . 0.0 111.693 168.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -152.26 127.87 10.09 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 125.104 1.362 . . . . 0.0 108.251 162.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -119.96 137.46 54.05 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.801 1.24 . . . . 0.0 110.001 -173.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.6 t -61.52 148.14 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-O 121.514 0.673 . . . . 0.0 112.365 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.9 t -137.18 94.39 2.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.081 1.352 . . . . 0.0 110.996 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.171 1.788 . . . . 0.0 112.506 178.558 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo . . . . . 0 CA--C 1.537 0.635 0 N-CA-C 113.107 0.387 . . . . 0.0 113.107 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.12 171.91 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.91 2.084 . . . . 0.0 109.619 -177.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -102.33 129.7 48.85 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.285 1.034 . . . . 0.0 110.31 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -133.31 156.26 47.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 111.871 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.97 151.98 20.72 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.074 1.35 . . . . 0.0 112.457 175.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -74.6 120.96 20.86 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.713 1.605 . . . . 0.0 111.805 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -142.24 116.12 9.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.927 1.691 . . . . 0.0 110.207 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -133.22 147.43 51.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.924 1.69 . . . . 0.0 111.002 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.7 t -154.51 175.23 13.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.544 1.538 . . . . 0.0 111.549 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -139.41 101.19 4.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.473 1.109 . . . . 0.0 110.318 171.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.02 179.54 7.91 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.592 1.157 . . . . 0.0 113.52 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.1 170.98 10.39 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 128.336 2.654 . . . . 0.0 113.732 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -142.35 141.3 32.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.06 1.744 . . . . 0.0 112.008 -176.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.6 t -102.09 142.66 33.0 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.038 0.923 . . . . 0.0 111.619 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.4 m -147.24 -178.7 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.559 1.944 . . . . 0.0 111.241 -175.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.0 m -125.72 117.71 24.05 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.177 -0.952 . . . . 0.0 111.525 174.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.09 131.51 34.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.783 0.833 . . . . 0.0 111.413 174.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -140.32 111.44 7.08 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.126 1.37 . . . . 0.0 108.562 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 59.9 56.79 3.33 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.409 1.484 . . . . 0.0 112.456 -169.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.41 24.66 13.24 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.723 2.409 . . . . 0.0 115.102 169.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.66 133.05 5.69 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 125.142 1.377 . . . . 0.0 109.445 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -76.42 105.55 2.1 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.874 3.05 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 5.7 m -101.96 15.46 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.714 1.606 . . . . 0.0 112.102 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -156.79 146.45 20.73 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 120.216 1.371 . . . . 0.0 112.759 -175.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -101.12 135.62 42.3 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.601 1.16 . . . . 0.0 111.391 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 99.6 t -110.16 -53.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.016 0.926 . . . . 0.0 112.018 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.53 -174.23 45.35 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 119.006 0.821 . . . . 0.0 114.459 -174.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 t -123.54 127.62 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 109.511 -176.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.82 4.51 7.34 Favored Glycine 0 CA--C 1.542 1.777 0 N-CA-C 116.376 1.311 . . . . 0.0 116.376 -176.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.3 t -167.87 160.82 12.65 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.269 2.228 . . . . 0.0 111.111 -175.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 86.9 m . . . . . 0 CA--C 1.543 0.7 0 C-N-CA 126.222 1.809 . . . . 0.0 110.998 172.971 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 122.539 1.161 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -56.24 -37.95 70.45 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.613 1.965 . . . . 0.0 111.875 166.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.1 90.29 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.941 1.297 . . . . 0.0 111.797 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.6 p -83.1 -30.84 27.64 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.316 1.446 . . . . 0.0 113.411 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -53.27 -38.68 63.29 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.68 1.592 . . . . 0.0 113.111 176.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -59.29 -62.73 1.67 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.744 0.818 . . . . 0.0 110.702 171.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -58.62 -23.94 59.98 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -64.35 -48.06 76.95 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.376 1.87 . . . . 0.0 113.257 177.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -155.15 25.19 0.42 Allowed 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.688 1.736 . . . . 0.0 115.688 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.3 mt -128.8 147.78 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.111 -1.618 . . . . 0.0 109.612 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.3 t -146.99 159.38 43.63 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -96.46 4.1 52.35 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 126.626 1.97 . . . . 0.0 112.494 168.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.0 t -161.98 115.76 1.85 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.305 1.842 . . . . 0.0 110.898 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttp-105 -67.36 106.2 2.01 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.574 -1.329 . . . . 0.0 110.724 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -115.51 3.56 14.07 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.293 1.437 . . . . 0.0 113.567 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 p -72.18 143.51 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.708 1.203 . . . . 0.0 112.368 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -130.38 6.54 4.87 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.06 1.744 . . . . 0.0 112.782 170.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.6 m 51.5 38.62 22.63 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.843 2.457 . . . . 0.0 113.962 -177.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -154.67 -27.76 0.12 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.112 2.565 . . . . 0.0 112.895 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -107.61 1.69 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.771 1.629 . . . . 0.0 113.527 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.2 pt -59.86 -13.46 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.43 1.492 . . . . 0.0 113.662 176.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -53.77 -26.05 21.82 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.065 1.346 . . . . 0.0 114.259 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -91.3 -13.23 32.99 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.082 1.353 . . . . 0.0 113.645 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.6 p -93.45 -176.0 3.97 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.792 1.637 . . . . 0.0 112.051 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -64.19 -18.39 64.45 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 169.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -93.16 11.36 28.07 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.011 1.724 . . . . 0.0 114.261 -167.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -64.98 -6.33 8.3 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 128.764 2.825 . . . . 0.0 115.01 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -62.35 -2.39 1.01 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.845 2.058 . . . . 0.0 114.805 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t 53.84 34.04 18.41 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.456 1.902 . . . . 0.0 113.874 -175.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 155.63 12.24 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.881 1.672 . . . . 0.0 112.242 174.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -71.13 -26.67 63.11 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.4 pttt -164.82 165.83 20.22 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 112.236 167.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -137.41 163.65 30.55 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.199 1.0 . . . . 0.0 111.554 166.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.0 m -127.76 92.1 3.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.275 1.43 . . . . 0.0 110.0 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.56 122.86 25.21 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.774 0.83 . . . . 0.0 110.848 175.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.9 mt -99.59 116.23 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.035 1.334 . . . . 0.0 107.812 174.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -89.37 87.35 7.07 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.313 0.578 . . . . 0.0 110.539 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 93.8 p -148.94 166.39 28.75 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.136 1.375 . . . . 0.0 112.602 171.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 30.1 mtt85 -74.17 161.72 77.08 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 124.715 1.206 . . . . 0.0 111.528 170.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.51 -22.32 38.8 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.305 2.003 . . . . 0.0 114.457 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -58.01 17.04 Favored Pre-proline 0 N--CA 1.473 0.72 0 CA-C-N 119.605 1.093 . . . . 0.0 112.714 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.77 -0.57 5.49 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 123.138 2.559 . . . . 0.0 114.94 178.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.4 t -101.14 -55.56 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 126.426 1.89 . . . . 0.0 109.7 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -45.53 81.26 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.087 -1.008 . . . . 0.0 112.971 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.59 -2.9 31.35 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -172.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.3 mt -53.44 -35.63 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.664 0.786 . . . . 0.0 110.468 169.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.5 p -110.38 159.23 17.65 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.63 1.172 . . . . 0.0 113.235 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -156.44 103.11 2.12 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.162 1.785 . . . . 0.0 110.005 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.5 3.55 81.17 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.596 1.093 . . . . 0.0 114.961 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.4 mt -75.31 116.48 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 118.63 1.215 . . . . 0.0 111.241 -178.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.4 mt -110.37 -13.44 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.516 1.926 . . . . 0.0 111.079 173.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.74 2.62 5.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 127.38 2.272 . . . . 0.0 116.298 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t 52.27 67.58 0.95 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.79 1.636 . . . . 0.0 112.507 -170.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -155.14 156.47 35.81 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.646 1.978 . . . . 0.0 110.878 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -140.72 -171.93 3.34 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.752 -1.218 . . . . 0.0 111.702 162.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.0 t -123.78 139.85 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.647 1.579 . . . . 0.0 108.452 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 34.0 tp -48.44 140.31 8.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.624 1.17 . . . . 0.0 111.893 170.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.45 174.06 0.81 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 174.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.5 t -122.48 -21.59 5.71 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.803 1.241 . . . . 0.0 114.201 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.8 m -86.25 171.47 11.23 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.25 1.42 . . . . 0.0 111.765 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -119.01 109.85 16.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.107 0.963 . . . . 0.0 111.26 -176.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -105.09 159.93 15.45 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 110.295 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.74 108.83 3.56 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.153 0.502 . . . . 0.0 110.35 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.91 121.28 41.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.347 1.459 . . . . 0.0 111.202 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.6 t -125.25 90.44 3.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.106 1.363 . . . . 0.0 110.717 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -80.97 161.09 24.44 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.547 0.739 . . . . 0.0 110.864 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -150.44 134.71 17.09 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 120.937 -1.102 . . . . 0.0 108.185 156.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.99 141.03 52.14 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.051 1.34 . . . . 0.0 109.228 -174.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.5 t -63.36 148.96 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-O 121.701 0.763 . . . . 0.0 112.114 -177.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.3 t -139.68 85.94 2.07 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.955 1.302 . . . . 0.0 111.874 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.252 1.198 0 C-N-CA 126.533 1.933 . . . . 0.0 113.709 178.633 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo . . . . . 0 CA--C 1.537 0.672 0 CA-C-O 120.519 0.133 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -138.98 176.14 8.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.308 1.843 . . . . 0.0 110.353 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -95.27 127.34 41.24 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.568 1.147 . . . . 0.0 110.2 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -135.39 159.25 42.16 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.563 1.145 . . . . 0.0 111.957 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.33 151.68 25.67 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.907 1.683 . . . . 0.0 112.722 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.63 110.22 12.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.204 1.802 . . . . 0.0 111.742 -172.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -134.11 117.7 16.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.587 1.555 . . . . 0.0 111.372 177.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -132.35 151.6 51.79 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.806 1.643 . . . . 0.0 111.406 173.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -152.75 177.04 11.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.114 1.366 . . . . 0.0 112.012 176.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -144.41 103.98 4.03 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.044 0.938 . . . . 0.0 111.058 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.58 172.6 6.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.375 1.47 . . . . 0.0 113.224 -173.269 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.12 171.86 1.19 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 127.585 2.354 . . . . 0.0 114.355 168.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -142.65 146.27 34.3 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.559 1.944 . . . . 0.0 111.597 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.0 t -106.5 142.46 36.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.088 0.955 . . . . 0.0 111.63 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -147.14 -179.53 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.471 1.908 . . . . 0.0 111.697 -174.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.7 m -126.42 119.81 28.18 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.225 -0.922 . . . . 0.0 111.818 174.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.4 t -85.17 128.83 34.82 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.34 1.056 . . . . 0.0 111.341 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -136.5 113.31 10.3 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.023 1.329 . . . . 0.0 108.988 176.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 58.27 57.83 3.76 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.985 1.314 . . . . 0.0 112.453 -172.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.98 26.25 14.08 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.398 2.279 . . . . 0.0 114.763 170.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.53 134.16 5.96 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 124.94 1.296 . . . . 0.0 109.516 -177.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -75.32 105.46 2.09 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.698 2.932 . . . . 0.0 112.228 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.9 m -99.41 11.8 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.26 1.424 . . . . 0.0 111.968 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -155.75 142.25 18.63 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.114 1.325 . . . . 0.0 112.595 -170.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -98.02 137.6 36.59 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.391 1.076 . . . . 0.0 111.351 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.6 t -111.3 -55.49 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.133 0.973 . . . . 0.0 112.028 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.57 -173.65 43.24 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 118.983 0.811 . . . . 0.0 115.123 -171.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.9 t -127.54 124.03 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.874 1.67 . . . . 0.0 110.051 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.04 3.96 10.08 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.0 p -168.96 163.98 11.47 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.647 2.379 . . . . 0.0 110.924 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m . . . . . 0 CA--C 1.54 0.58 0 C-N-CA 125.112 1.365 . . . . 0.0 110.611 172.015 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 . . . . . 0 CA--C 1.544 0.725 0 CA-C-O 122.059 0.933 . . . . 0.0 109.687 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.4 ' NE1' ' HE3' ' A' ' 93' ' ' LYS . 3.4 t-105 -55.45 -37.94 68.4 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.705 2.002 . . . . 0.0 112.063 167.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -42.34 83.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.827 1.251 . . . . 0.0 111.329 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -87.82 -27.57 22.19 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.568 1.547 . . . . 0.0 114.084 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -50.48 -42.86 55.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.934 1.694 . . . . 0.0 112.782 173.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.67 -62.45 1.72 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.454 1.102 . . . . 0.0 110.797 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -60.31 -23.03 63.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -178.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -64.57 -52.58 56.89 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.34 1.456 . . . . 0.0 113.163 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -149.95 22.64 0.87 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -175.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -125.69 150.08 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 120.362 -1.461 . . . . 0.0 109.246 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.6 t -145.39 152.58 40.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -84.31 -1.81 55.97 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.156 1.782 . . . . 0.0 112.963 168.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -163.65 114.71 1.37 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.391 1.876 . . . . 0.0 111.178 176.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -66.59 105.87 1.64 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.348 -1.47 . . . . 0.0 110.683 173.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -115.18 1.29 13.81 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.275 1.43 . . . . 0.0 113.595 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.7 p -72.3 143.04 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.818 1.247 . . . . 0.0 112.229 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -130.77 12.66 5.31 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.123 1.769 . . . . 0.0 112.226 170.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.4 m 51.67 38.41 22.67 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.905 2.482 . . . . 0.0 112.704 -173.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -147.86 -43.01 0.16 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.808 2.443 . . . . 0.0 112.519 -168.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.4 p30 -93.0 -6.26 48.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.141 1.377 . . . . 0.0 113.347 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.9 pt -63.34 -10.78 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.509 1.124 . . . . 0.0 113.492 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -56.38 -19.78 16.38 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.887 1.275 . . . . 0.0 114.128 164.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.3 t -114.76 -2.33 13.02 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.425 1.89 . . . . 0.0 113.78 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.5 p -98.52 -174.37 2.79 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.122 1.369 . . . . 0.0 110.886 172.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -64.02 -18.08 63.97 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.801 -1.187 . . . . 0.0 113.622 173.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -94.53 14.03 22.12 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.867 1.667 . . . . 0.0 114.275 -165.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -66.32 -4.16 7.39 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 128.514 2.726 . . . . 0.0 114.922 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -62.96 -2.9 1.36 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.651 1.98 . . . . 0.0 115.16 -174.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.8 t 57.17 32.26 21.41 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.938 1.695 . . . . 0.0 113.596 -176.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.21 155.27 25.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.103 1.361 . . . . 0.0 112.334 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -64.62 -30.99 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -170.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.25 164.17 22.54 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.015 1.726 . . . . 0.0 111.407 166.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -128.78 159.26 36.25 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.184 0.593 . . . . 0.0 110.159 161.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.1 m -122.05 93.51 4.01 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.828 1.251 . . . . 0.0 109.578 173.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -78.25 128.0 33.08 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.563 0.745 . . . . 0.0 111.114 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.1 mt -103.4 111.77 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.385 1.474 . . . . 0.0 107.447 173.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -80.62 88.83 5.69 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.728 -0.608 . . . . 0.0 109.69 168.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 71.1 m -149.21 159.31 44.36 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.069 1.348 . . . . 0.0 112.849 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -73.39 162.75 72.88 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 124.641 1.176 . . . . 0.0 110.35 166.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.8 -23.13 30.97 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.135 1.89 . . . . 0.0 114.428 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.97 -56.84 27.99 Favored Pre-proline 0 N--CA 1.474 0.744 0 CA-C-O 117.974 -1.013 . . . . 0.0 113.183 -176.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.69 -1.12 7.87 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.982 2.455 . . . . 0.0 114.863 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.2 t -100.81 -54.32 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.282 1.833 . . . . 0.0 109.668 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.4 ' HE3' ' NE1' ' A' ' 51' ' ' TRP . 0.0 OUTLIER -67.01 -44.79 79.41 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.225 -0.922 . . . . 0.0 112.969 -179.882 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.25 -4.2 37.62 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -172.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.7 mt -53.08 -35.22 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.876 0.87 . . . . 0.0 110.799 170.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.6 p -112.53 158.07 20.38 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.271 1.429 . . . . 0.0 113.315 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -154.83 107.79 2.81 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.56 1.944 . . . . 0.0 109.803 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.56 3.24 88.51 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.411 1.005 . . . . 0.0 114.957 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 51.1 mt -76.43 117.62 21.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.887 1.275 . . . . 0.0 111.037 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.98 -12.04 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 126.729 2.012 . . . . 0.0 110.964 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 3.7 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.325 2.25 . . . . 0.0 116.12 -170.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.26 67.93 0.9 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.736 1.614 . . . . 0.0 113.062 -171.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -158.53 153.56 25.25 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.164 1.786 . . . . 0.0 110.717 177.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -138.46 -170.91 2.93 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.822 -1.174 . . . . 0.0 111.128 165.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.0 t -125.59 139.85 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.431 1.492 . . . . 0.0 108.578 173.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.0 tp -48.77 139.72 9.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.502 1.121 . . . . 0.0 111.947 170.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.25 172.33 1.51 Allowed 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 174.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -120.09 -24.47 6.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.701 1.201 . . . . 0.0 113.996 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -82.07 172.68 12.94 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.233 1.413 . . . . 0.0 112.089 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -119.16 105.36 11.3 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.595 1.158 . . . . 0.0 111.382 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -100.61 162.29 13.03 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.0 1.72 . . . . 0.0 110.854 -174.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -73.49 105.37 4.81 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.759 -0.588 . . . . 0.0 110.506 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.83 123.09 39.25 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.741 1.216 . . . . 0.0 111.471 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 42.4 t -127.05 91.2 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.006 1.322 . . . . 0.0 110.892 -174.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -83.95 164.39 19.41 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.682 0.753 . . . . 0.0 111.591 169.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -154.2 119.87 5.21 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.192 -0.943 . . . . 0.0 109.025 161.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -107.66 139.46 42.17 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.325 1.05 . . . . 0.0 110.239 -174.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.14 149.55 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.174 0.589 . . . . 0.0 112.198 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.1 t -142.14 95.06 2.74 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 122.099 0.952 . . . . 0.0 112.667 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.864 2.066 . . . . 0.0 113.952 179.127 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 CA--C 1.541 0.857 0 CA-C-O 120.47 0.112 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -144.84 -178.11 5.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.774 2.029 . . . . 0.0 110.742 -174.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -105.45 127.08 52.8 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.352 1.461 . . . . 0.0 110.418 177.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -134.34 164.29 27.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.888 1.275 . . . . 0.0 112.23 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -116.04 153.29 31.95 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.793 2.037 . . . . 0.0 112.646 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.33 113.99 22.07 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.475 1.91 . . . . 0.0 111.577 -168.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -137.87 103.06 4.88 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.641 1.576 . . . . 0.0 112.424 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -117.35 140.98 48.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.079 1.351 . . . . 0.0 111.279 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -147.2 165.68 29.3 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.648 1.579 . . . . 0.0 111.484 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -140.21 103.67 4.64 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.614 -0.679 . . . . 0.0 111.209 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.48 170.7 5.72 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.803 1.241 . . . . 0.0 113.248 -169.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 171.62 1.45 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.571 2.349 . . . . 0.0 113.89 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.5 p90 -141.83 147.0 36.51 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.336 1.854 . . . . 0.0 111.453 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.6 t -105.45 144.31 32.39 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.839 0.856 . . . . 0.0 111.063 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.8 m -148.36 -178.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.336 1.855 . . . . 0.0 111.804 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -128.09 117.66 22.03 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.022 1.329 . . . . 0.0 111.877 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 18.7 t -85.32 129.43 34.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.467 1.107 . . . . 0.0 111.729 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -135.61 114.1 11.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 125.021 1.329 . . . . 0.0 109.113 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 57.46 57.25 4.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.876 1.27 . . . . 0.0 112.445 -172.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.4 26.18 13.5 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.458 2.303 . . . . 0.0 114.745 170.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.01 134.29 5.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.111 1.365 . . . . 0.0 109.709 -177.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.55 110.08 3.03 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 123.551 2.834 . . . . 0.0 113.351 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.4 m -108.01 17.03 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 126.42 1.888 . . . . 0.0 112.347 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -153.8 141.3 19.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.66 -1.275 . . . . 0.0 111.113 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -84.69 154.23 22.6 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.124 0.57 . . . . 0.0 110.274 169.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.1 t -130.1 -44.6 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.04 -174.96 47.23 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 119.74 1.155 . . . . 0.0 115.262 -174.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -130.79 116.67 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.03 1.732 . . . . 0.0 110.024 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.34 3.29 31.06 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 115.17 0.828 . . . . 0.0 115.17 -174.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 98.4 p -167.9 167.6 12.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 128.156 2.582 . . . . 0.0 110.387 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 78.4 m . . . . . 0 CA--C 1.539 0.555 0 C-N-CA 125.256 1.422 . . . . 0.0 110.34 171.179 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 . . . . . 0 CA--C 1.542 0.65 0 CA-C-O 122.038 0.923 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -56.48 -37.41 70.32 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 126.076 1.751 . . . . 0.0 111.734 168.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.63 -37.62 76.31 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.486 1.114 . . . . 0.0 111.731 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -90.94 -27.1 18.93 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.599 1.16 . . . . 0.0 113.926 175.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -51.07 -43.01 60.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 126.136 1.774 . . . . 0.0 113.036 174.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -56.4 -62.21 1.88 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.507 1.123 . . . . 0.0 110.961 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.59 -27.49 62.76 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.8 tptt -65.11 -51.02 63.74 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.019 1.328 . . . . 0.0 113.726 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -148.84 22.82 0.99 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -128.3 147.94 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.11 1.364 . . . . 0.0 109.434 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.4 t -147.88 154.36 40.3 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -85.65 1.51 48.97 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.21 1.804 . . . . 0.0 113.112 167.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.6 t -162.38 104.19 1.1 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.685 1.994 . . . . 0.0 110.953 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -67.33 109.06 2.98 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.546 -1.346 . . . . 0.0 110.121 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.81 5.69 17.64 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.305 1.442 . . . . 0.0 113.005 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -77.2 139.3 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.871 1.268 . . . . 0.0 111.898 -174.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -127.36 7.86 6.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.096 1.758 . . . . 0.0 112.819 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 m 53.03 37.26 24.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.424 2.29 . . . . 0.0 113.816 -178.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -151.03 -33.36 0.16 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.831 2.452 . . . . 0.0 111.853 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -97.52 -5.25 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.852 1.661 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.7 pt -62.32 -12.21 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.947 1.299 . . . . 0.0 113.633 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -55.68 -33.39 64.09 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.738 0.815 . . . . 0.0 112.387 168.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -77.54 -12.57 59.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.263 1.425 . . . . 0.0 114.207 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -100.49 -175.36 2.89 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.539 1.536 . . . . 0.0 112.422 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -63.34 -19.95 65.08 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -94.25 12.79 25.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.783 1.633 . . . . 0.0 114.199 -165.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -64.68 -5.79 6.47 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 128.999 2.919 . . . . 0.0 115.136 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -62.32 -2.06 0.91 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.739 2.016 . . . . 0.0 114.919 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.8 t 55.98 31.46 18.0 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.101 1.76 . . . . 0.0 113.981 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 156.81 24.37 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.847 1.659 . . . . 0.0 112.527 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -63.23 -34.13 76.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.654 1.182 . . . . 0.0 114.155 -171.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.4 ptmm? -162.64 160.57 25.87 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.913 1.685 . . . . 0.0 112.473 168.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -129.85 159.01 37.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.029 0.932 . . . . 0.0 110.152 161.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.9 m -123.7 92.73 3.74 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.164 1.386 . . . . 0.0 109.503 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -79.48 121.85 25.71 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.166 0.986 . . . . 0.0 111.168 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.9 mt -97.25 117.25 41.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.242 1.417 . . . . 0.0 107.897 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -89.05 90.81 8.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.249 0.547 . . . . 0.0 110.294 167.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.0 p -144.67 172.04 13.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.337 1.455 . . . . 0.0 112.311 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -79.3 164.27 55.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 124.434 1.094 . . . . 0.0 109.779 164.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 -22.88 22.03 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.179 1.92 . . . . 0.0 114.284 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.24 -54.97 49.92 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-O 118.018 -0.991 . . . . 0.0 113.293 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.95 -1.28 8.36 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.236 2.624 . . . . 0.0 114.785 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 15.7 t -99.7 -53.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 126.141 1.776 . . . . 0.0 109.708 175.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -45.37 78.83 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.36 -0.837 . . . . 0.0 112.869 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.36 -3.54 37.42 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.3 mt -53.83 -36.19 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 123.514 0.726 . . . . 0.0 110.491 170.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.2 p -108.92 158.04 18.07 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.798 1.239 . . . . 0.0 113.031 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -156.2 104.84 2.27 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.657 1.583 . . . . 0.0 110.785 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 1.84 81.36 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.656 1.122 . . . . 0.0 115.002 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.66 119.91 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.899 1.279 . . . . 0.0 111.237 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.3 mt -112.27 -13.19 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.591 1.956 . . . . 0.0 110.927 173.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.93 4.14 5.77 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.441 2.296 . . . . 0.0 116.341 -168.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 53.2 68.16 0.88 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.646 1.579 . . . . 0.0 112.998 -171.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -159.83 152.86 21.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.161 1.784 . . . . 0.0 110.907 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -141.65 -170.24 3.07 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.817 -1.177 . . . . 0.0 111.524 166.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.92 142.62 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.747 1.619 . . . . 0.0 108.656 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.1 tp -51.12 140.66 15.7 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.229 1.011 . . . . 0.0 111.721 168.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.77 172.93 1.46 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -118.42 -31.47 4.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.872 1.269 . . . . 0.0 113.354 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.5 m -74.3 170.54 15.39 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.701 1.601 . . . . 0.0 112.334 175.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -120.34 102.31 8.39 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.326 1.051 . . . . 0.0 111.601 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -95.27 161.57 14.04 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.081 1.752 . . . . 0.0 110.978 -175.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -74.63 101.35 4.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.726 0.81 . . . . 0.0 110.53 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -96.1 128.8 43.33 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.943 1.297 . . . . 0.0 112.3 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.9 t -129.6 96.09 4.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.783 1.633 . . . . 0.0 110.672 -173.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -94.17 157.34 16.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.845 0.831 . . . . 0.0 111.585 172.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -147.43 117.86 7.43 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.271 1.028 . . . . 0.0 109.474 167.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -106.36 138.12 43.11 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.632 1.173 . . . . 0.0 110.099 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.9 t -61.15 146.92 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.673 0.789 . . . . 0.0 111.624 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 5.7 t -137.91 88.56 2.33 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.894 1.33 . . . . 0.0 111.39 174.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.343 1.857 . . . . 0.0 112.935 175.046 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo . . . . . 0 CA--C 1.545 1.071 0 N-CA-C 114.453 0.905 . . . . 0.0 114.453 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.2 m -127.62 160.4 31.74 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.171 1.788 . . . . 0.0 109.782 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.0 140.55 29.38 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.509 1.124 . . . . 0.0 110.136 173.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -138.93 159.75 41.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.057 1.343 . . . . 0.0 112.32 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -92.67 156.22 17.21 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.144 2.178 . . . . 0.0 111.948 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -89.7 113.4 24.89 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.271 1.828 . . . . 0.0 111.128 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -137.16 93.06 2.78 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.884 1.274 . . . . 0.0 111.929 174.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -109.07 136.18 49.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.017 1.327 . . . . 0.0 110.758 177.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 m -143.46 171.46 14.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.591 1.556 . . . . 0.0 111.737 -174.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -143.54 104.68 4.25 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.137 -0.977 . . . . 0.0 111.439 175.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.52 172.72 4.97 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.112 1.365 . . . . 0.0 113.332 -169.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.37 173.42 1.57 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.551 2.34 . . . . 0.0 114.233 168.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -142.88 147.53 35.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.759 2.024 . . . . 0.0 111.51 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -107.25 142.55 36.83 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.028 0.931 . . . . 0.0 111.501 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.1 m -147.98 -178.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 126.305 1.842 . . . . 0.0 111.65 -174.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 m -127.06 119.69 27.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.115 0.966 . . . . 0.0 111.195 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.73 132.73 34.03 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.708 0.803 . . . . 0.0 111.365 174.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -137.08 118.23 14.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.365 1.466 . . . . 0.0 108.488 174.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 56.37 55.44 6.61 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.65 1.18 . . . . 0.0 112.495 -171.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.54 25.16 11.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.675 2.39 . . . . 0.0 115.038 169.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.11 133.33 6.1 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 124.779 1.232 . . . . 0.0 109.439 -175.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.0 104.57 1.93 Allowed 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.848 3.032 . . . . 0.0 112.163 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.7 m -102.05 14.59 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.394 1.478 . . . . 0.0 112.194 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -156.59 142.59 18.0 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 120.111 1.323 . . . . 0.0 112.259 -173.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -97.58 141.19 30.92 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.258 1.023 . . . . 0.0 111.216 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 78.0 t -115.71 -53.86 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.057 0.943 . . . . 0.0 112.208 177.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.8 -172.78 42.64 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 119.122 0.874 . . . . 0.0 115.089 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -128.5 122.25 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 126.006 1.722 . . . . 0.0 110.034 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.82 1.46 12.03 Favored Glycine 0 CA--C 1.541 1.672 0 N-CA-C 115.856 1.102 . . . . 0.0 115.856 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.6 t -169.08 164.63 11.29 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.879 2.472 . . . . 0.0 110.316 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.6 m . . . . . 0 CA--C 1.541 0.62 0 C-N-CA 125.841 1.657 . . . . 0.0 111.174 173.798 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 CA--C 1.539 0.522 0 CA-C-O 122.805 1.288 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.8 t-105 -54.74 -36.69 65.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.427 1.891 . . . . 0.0 112.41 170.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -26.97 68.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.753 1.221 . . . . 0.0 113.06 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.7 p -89.43 -31.6 17.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.658 1.183 . . . . 0.0 113.649 167.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.01 -39.69 72.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.89 1.676 . . . . 0.0 113.11 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -57.42 -65.43 0.63 Allowed 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.435 1.094 . . . . 0.0 110.526 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -60.67 -22.33 63.78 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -61.73 -55.09 33.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.465 1.506 . . . . 0.0 113.329 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -147.88 21.96 1.12 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -172.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.0 mt -129.22 146.84 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.095 1.358 . . . . 0.0 109.695 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.9 t -147.35 153.82 40.15 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 174.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -84.73 0.86 49.05 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.088 1.755 . . . . 0.0 113.112 168.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.2 t -161.26 105.76 1.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.529 1.932 . . . . 0.0 110.932 175.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -66.99 108.34 2.56 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.545 -1.347 . . . . 0.0 110.13 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -114.44 4.38 15.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.328 1.451 . . . . 0.0 113.026 176.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.4 t -83.4 138.04 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.133 0.973 . . . . 0.0 111.437 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -124.55 8.61 8.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.127 1.771 . . . . 0.0 112.398 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.3 m 52.03 44.64 29.37 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.385 2.274 . . . . 0.0 113.26 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -160.55 -20.07 0.06 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.201 2.2 . . . . 0.0 113.718 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -106.39 -1.98 22.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.826 1.25 . . . . 0.0 113.671 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.45 -13.72 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.434 1.493 . . . . 0.0 114.195 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 4.6 ptm -51.07 -25.11 4.53 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.23 1.412 . . . . 0.0 114.587 164.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 t -95.66 -15.58 22.62 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.663 1.585 . . . . 0.0 113.584 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 p -90.39 -174.73 4.25 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.698 1.599 . . . . 0.0 112.188 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -63.38 -20.73 65.79 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.146 -0.971 . . . . 0.0 113.572 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.27 20.01 8.7 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.606 1.963 . . . . 0.0 113.424 -170.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -65.59 -10.12 32.72 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.601 2.36 . . . . 0.0 114.537 -174.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -61.8 -3.13 1.01 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.89 2.476 . . . . 0.0 115.369 -175.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.93 25.47 6.83 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.296 1.838 . . . . 0.0 114.185 -177.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 161.3 4.27 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 113.692 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -63.98 -34.81 78.84 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.472 1.509 . . . . 0.0 114.346 -168.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -165.35 158.53 16.25 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.446 1.498 . . . . 0.0 112.421 175.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -140.43 128.23 21.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.797 1.239 . . . . 0.0 110.015 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 54.2 m -91.87 94.34 9.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.679 1.192 . . . . 0.0 110.551 171.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -79.81 125.91 30.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.243 0.617 . . . . 0.0 111.175 175.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.0 mt -99.8 114.48 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.367 1.467 . . . . 0.0 108.057 172.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -84.91 87.36 7.34 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.735 -0.603 . . . . 0.0 110.109 167.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 t -152.17 171.23 18.25 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.201 1.0 . . . . 0.0 113.138 170.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -77.07 163.85 62.6 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.975 2.11 . . . . 0.0 110.852 173.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.58 -23.2 23.48 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.347 2.031 . . . . 0.0 114.408 176.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -60.15 -57.93 23.06 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 124.605 1.162 . . . . 0.0 113.211 -177.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -70.0 -0.81 7.66 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.164 2.576 . . . . 0.0 114.813 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -100.26 -55.19 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.327 1.851 . . . . 0.0 109.549 176.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -44.2 82.39 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.224 -0.922 . . . . 0.0 112.97 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.21 -4.38 38.56 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 61.7 mt -53.17 -36.01 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.713 0.805 . . . . 0.0 110.672 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 32.0 p -110.22 159.1 17.69 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.528 1.131 . . . . 0.0 113.056 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -156.35 103.77 2.18 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.623 1.569 . . . . 0.0 110.688 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.65 3.7 85.97 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.288 0.947 . . . . 0.0 114.912 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.3 mt -74.32 115.22 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.544 1.172 . . . . 0.0 111.161 -178.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.9 mt -108.43 -14.11 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.442 1.897 . . . . 0.0 110.867 171.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.42 5.76 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.732 2.413 . . . . 0.0 116.396 -169.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.2 t 51.42 65.87 1.36 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.498 1.519 . . . . 0.0 112.862 -171.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -154.89 157.06 37.23 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.206 1.803 . . . . 0.0 111.106 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -142.29 -170.15 3.11 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.859 -1.151 . . . . 0.0 111.778 163.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.15 142.4 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.833 1.653 . . . . 0.0 108.625 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp -49.67 140.86 10.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.587 1.155 . . . . 0.0 111.945 169.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.49 172.66 1.48 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -118.06 -30.54 5.3 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.89 1.276 . . . . 0.0 113.474 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.2 m -76.91 171.5 14.66 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.801 1.64 . . . . 0.0 112.457 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -118.84 102.34 8.73 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.434 1.094 . . . . 0.0 111.667 -176.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -95.53 161.62 13.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.007 1.723 . . . . 0.0 111.135 -176.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -75.22 100.83 4.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.327 0.651 . . . . 0.0 110.537 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.24 128.99 37.28 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.203 . . . . 0.0 112.049 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 44.4 t -130.59 90.08 2.87 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 125.654 1.581 . . . . 0.0 110.074 -175.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -88.6 160.2 17.53 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.865 0.84 . . . . 0.0 111.419 171.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.3 m -147.35 142.79 27.47 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 125.586 1.554 . . . . 0.0 107.951 164.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -132.76 128.91 37.85 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.616 1.167 . . . . 0.0 109.755 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.6 t -57.77 147.22 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.962 0.905 . . . . 0.0 111.703 -176.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.65 103.61 5.28 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.158 0.983 . . . . 0.0 112.31 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.563 1.945 . . . . 0.0 113.473 179.748 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo . . . . . 0 CA--C 1.539 0.736 0 N-CA-C 112.538 0.168 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.89 175.81 10.15 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.022 2.129 . . . . 0.0 110.119 -177.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -106.82 128.65 54.44 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.877 1.271 . . . . 0.0 110.672 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -135.22 158.19 45.01 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.78 1.232 . . . . 0.0 112.669 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.0 mtpp -89.02 155.9 19.2 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.618 2.367 . . . . 0.0 111.407 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.29 105.13 17.25 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.573 1.549 . . . . 0.0 110.513 -176.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -132.3 101.9 5.55 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.131 1.373 . . . . 0.0 112.278 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -114.08 137.51 51.63 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.608 1.563 . . . . 0.0 110.971 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.2 m -142.33 169.13 18.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.868 1.667 . . . . 0.0 111.047 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -143.54 103.79 4.14 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.077 -1.015 . . . . 0.0 111.387 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.83 172.16 6.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.799 1.24 . . . . 0.0 113.535 -170.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.81 170.28 0.43 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 128.974 2.909 . . . . 0.0 114.327 165.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.58 150.47 36.45 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.884 2.074 . . . . 0.0 111.395 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.1 t -112.29 146.25 38.55 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.845 0.831 . . . . 0.0 112.434 176.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.2 m -149.19 -177.31 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.596 1.958 . . . . 0.0 111.697 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.6 m -128.11 116.26 19.68 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 125.029 1.332 . . . . 0.0 111.908 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.5 t -83.91 130.24 34.91 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.101 0.96 . . . . 0.0 111.433 176.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -137.09 115.04 11.45 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.954 1.302 . . . . 0.0 108.969 174.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 57.53 57.31 4.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.869 1.268 . . . . 0.0 112.498 -172.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 64.4 26.1 13.48 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.254 2.222 . . . . 0.0 114.734 170.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.21 134.43 5.77 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.227 1.411 . . . . 0.0 109.528 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.498 2.799 . . . . 0.0 113.317 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.8 m -106.62 16.84 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.498 1.919 . . . . 0.0 112.566 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -153.14 142.97 22.08 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.631 -1.293 . . . . 0.0 111.322 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -84.38 154.52 22.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.986 0.514 . . . . 0.0 110.419 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.3 t -124.28 -55.49 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.571 0.749 . . . . 0.0 112.339 167.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.09 -172.34 43.25 Favored Glycine 0 CA--C 1.53 1.028 0 CA-C-N 119.028 0.831 . . . . 0.0 115.104 -170.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -127.13 123.03 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.823 1.649 . . . . 0.0 110.672 -169.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.24 1.04 8.72 Favored Glycine 0 CA--C 1.541 1.66 0 C-N-CA 124.973 1.273 . . . . 0.0 115.97 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.7 m -166.09 166.6 17.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 129.912 3.285 . . . . 0.0 108.964 -174.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t . . . . . 0 CA--C 1.541 0.606 0 C-N-CA 124.424 1.09 . . . . 0.0 111.181 -179.217 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 CA--C 1.545 0.755 0 CA-C-O 122.3 1.048 . . . . 0.0 110.611 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -56.96 -35.94 69.72 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.748 2.019 . . . . 0.0 112.297 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -32.01 70.1 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.971 1.309 . . . . 0.0 112.448 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.8 p -92.22 -28.72 16.85 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.734 1.613 . . . . 0.0 113.859 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -52.73 -45.48 67.0 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.429 1.492 . . . . 0.0 112.55 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -55.61 -60.68 3.09 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.417 1.087 . . . . 0.0 110.812 175.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 34.1 mttp -58.01 -25.26 60.87 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmtp -68.49 -54.38 17.23 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.058 1.343 . . . . 0.0 113.687 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -141.7 14.91 2.14 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.81 1.782 . . . . 0.0 115.81 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.0 mt -126.33 146.09 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 O-C-N 120.771 -1.205 . . . . 0.0 110.066 175.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -142.56 151.92 42.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.392 0.677 . . . . 0.0 112.352 170.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -87.73 0.32 55.89 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.207 1.403 . . . . 0.0 112.206 170.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 t -159.44 107.17 1.76 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.421 1.888 . . . . 0.0 110.593 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -64.35 105.41 0.92 Allowed 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.734 -1.229 . . . . 0.0 110.973 175.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -112.25 1.77 16.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.347 1.459 . . . . 0.0 113.431 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.6 p -75.22 145.52 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.087 1.355 . . . . 0.0 112.572 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -132.34 8.42 4.3 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.172 1.789 . . . . 0.0 112.782 172.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 52.1 m 51.45 37.38 19.14 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.786 2.434 . . . . 0.0 114.011 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -148.28 -22.05 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.421 2.689 . . . . 0.0 112.896 176.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -106.65 -3.37 20.72 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.564 1.546 . . . . 0.0 113.398 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.2 pt -64.37 -8.94 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 113.571 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.6 ttt -56.67 -23.28 40.66 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.153 1.381 . . . . 0.0 113.123 164.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.8 t -99.86 -3.25 32.93 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.24 1.816 . . . . 0.0 114.076 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.6 p -107.42 -176.79 3.17 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.064 1.345 . . . . 0.0 111.373 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -64.37 -17.11 63.43 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.952 -1.092 . . . . 0.0 113.463 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -92.06 17.96 8.68 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.573 1.949 . . . . 0.0 113.849 -173.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -66.61 -8.01 24.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.707 2.003 . . . . 0.0 114.27 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -60.77 -2.47 0.55 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 128.252 2.621 . . . . 0.0 115.958 -175.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.9 t 49.09 53.73 12.11 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.182 1.793 . . . . 0.0 113.058 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 167.38 2.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.598 1.159 . . . . 0.0 112.303 170.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -76.49 -29.26 56.78 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.839 1.255 . . . . 0.0 112.764 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? -170.33 161.43 8.13 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.485 2.314 . . . . 0.0 110.642 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -147.08 143.45 28.33 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.599 0.76 . . . . 0.0 110.819 164.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 56.2 m -90.88 115.07 27.64 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.063 1.345 . . . . 0.0 109.197 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.94 128.34 43.8 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.481 1.037 . . . . 0.0 111.042 165.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.5 mt -99.97 112.87 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.662 1.585 . . . . 0.0 107.062 174.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -86.82 92.18 8.89 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.538 -0.726 . . . . 0.0 109.636 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 83.6 p -146.84 177.18 9.32 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.633 1.573 . . . . 0.0 112.728 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.31 160.04 46.27 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.385 1.474 . . . . 0.0 110.503 164.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -72.66 -22.08 21.15 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.584 2.189 . . . . 0.0 114.305 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.37 -55.78 41.85 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 124.902 1.281 . . . . 0.0 112.369 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.56 -0.93 7.45 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.371 2.714 . . . . 0.0 115.187 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.73 -53.89 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.718 1.607 . . . . 0.0 110.003 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -43.93 81.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.258 -0.902 . . . . 0.0 112.747 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.5 -3.49 37.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -172.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 56.6 mt -53.73 -35.78 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.627 0.771 . . . . 0.0 110.332 170.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.5 p -111.26 157.51 20.05 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.856 1.263 . . . . 0.0 113.304 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -154.5 110.62 3.23 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.571 1.948 . . . . 0.0 109.756 175.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.47 88.53 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.645 1.117 . . . . 0.0 114.873 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -77.47 116.82 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.681 1.192 . . . . 0.0 111.067 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.8 mt -111.61 -11.4 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.786 2.034 . . . . 0.0 110.769 173.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.2 5.89 4.03 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.617 2.367 . . . . 0.0 116.118 -170.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.3 t 52.71 64.93 1.67 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.568 1.547 . . . . 0.0 112.975 -173.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -157.33 152.57 26.11 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 126.053 1.741 . . . . 0.0 110.721 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -138.71 -172.03 3.21 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.909 -1.119 . . . . 0.0 111.645 164.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.8 t -124.37 141.22 45.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 125.59 1.556 . . . . 0.0 108.51 173.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.7 tp -49.63 140.93 10.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.505 1.122 . . . . 0.0 111.784 170.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.68 174.11 0.86 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 174.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 12.5 t -122.39 -20.92 5.95 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.114 1.366 . . . . 0.0 113.762 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.4 m -85.66 171.73 11.42 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.737 1.615 . . . . 0.0 111.902 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.32 109.53 16.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.446 1.099 . . . . 0.0 111.41 -178.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -105.12 160.19 15.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.926 1.69 . . . . 0.0 110.293 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -71.67 108.79 5.19 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.708 -0.62 . . . . 0.0 110.711 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -95.66 121.96 37.92 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.573 1.149 . . . . 0.0 111.574 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.4 t -121.92 88.66 2.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.269 1.828 . . . . 0.0 109.523 -175.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -88.14 158.62 18.49 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.384 -0.823 . . . . 0.0 111.166 173.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.2 m -145.74 141.23 27.81 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.041 0.936 . . . . 0.0 108.538 162.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -133.27 128.3 35.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.211 1.405 . . . . 0.0 110.008 -173.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.8 t -59.5 145.77 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-N 118.87 0.759 . . . . 0.0 112.54 -175.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.6 t -133.02 100.19 4.81 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.777 1.631 . . . . 0.0 111.011 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 C--O 1.253 1.284 0 C-N-CA 126.564 1.945 . . . . 0.0 111.519 -178.252 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 CA--C 1.54 0.793 0 CA-C-O 120.602 0.168 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.8 m -139.67 171.82 13.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.597 2.359 . . . . 0.0 109.813 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -91.51 137.19 32.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.716 1.207 . . . . 0.0 110.451 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -137.44 165.05 27.19 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.401 . . . . 0.0 111.94 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mtpt -98.84 159.02 15.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 127.247 2.219 . . . . 0.0 112.08 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.64 110.43 21.75 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.276 1.83 . . . . 0.0 111.583 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -135.8 115.66 13.09 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.203 1.801 . . . . 0.0 111.322 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -122.16 150.34 42.37 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.376 1.07 . . . . 0.0 111.548 176.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -150.48 170.65 18.59 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.987 1.315 . . . . 0.0 111.788 173.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -140.81 104.33 4.68 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.866 0.866 . . . . 0.0 110.963 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.6 172.99 7.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.146 1.378 . . . . 0.0 112.767 -172.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.85 172.21 1.39 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.41 1.884 . . . . 0.0 113.941 168.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -139.22 155.63 47.66 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.42 1.888 . . . . 0.0 110.161 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.5 t -113.91 146.24 40.34 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.078 1.351 . . . . 0.0 111.769 174.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.6 m -148.95 -178.45 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 126.415 1.886 . . . . 0.0 111.744 -175.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -125.51 117.73 24.24 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.96 1.304 . . . . 0.0 111.715 175.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.74 130.99 34.95 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.083 0.953 . . . . 0.0 111.503 176.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -138.51 112.66 8.61 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.127 1.371 . . . . 0.0 108.978 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 57.92 57.81 3.94 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.914 1.286 . . . . 0.0 112.451 -172.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 63.97 26.95 14.26 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.407 2.283 . . . . 0.0 114.776 170.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -160.08 134.89 5.53 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.231 1.413 . . . . 0.0 109.744 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -75.85 109.1 2.83 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.667 2.911 . . . . 0.0 113.38 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.7 m -109.27 17.56 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.611 1.965 . . . . 0.0 112.722 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -152.68 139.18 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.576 -1.328 . . . . 0.0 110.656 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -84.49 147.88 26.83 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.954 0.502 . . . . 0.0 110.879 170.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.4 t -121.28 -54.49 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.404 0.682 . . . . 0.0 112.573 175.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.87 -173.66 43.51 Favored Glycine 0 CA--C 1.528 0.865 0 CA-C-N 119.247 0.931 . . . . 0.0 115.149 -171.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 t -129.19 118.48 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.892 1.677 . . . . 0.0 110.181 -172.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.43 4.76 25.76 Favored Glycine 0 CA--C 1.542 1.75 0 N-CA-C 115.663 1.025 . . . . 0.0 115.663 -174.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.2 p -165.82 166.0 17.98 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.625 2.37 . . . . 0.0 111.123 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.0 m . . . . . 0 CA--C 1.539 0.553 0 C-N-CA 125.341 1.457 . . . . 0.0 110.526 172.486 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 p30 . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 122.606 1.194 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -59.74 -35.17 74.02 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 0.0 112.943 173.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -48.11 83.04 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.501 1.12 . . . . 0.0 110.977 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.8 p -74.53 -31.18 62.05 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.42 1.488 . . . . 0.0 113.481 174.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -54.79 -41.14 70.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.055 1.342 . . . . 0.0 113.068 175.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -60.43 -61.71 2.4 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.514 0.725 . . . . 0.0 110.484 173.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.12 -21.35 59.15 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -65.13 -56.53 12.41 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.235 1.814 . . . . 0.0 113.017 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -147.45 22.81 1.16 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.529 1.678 . . . . 0.0 115.529 -172.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -126.6 147.73 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.368 1.467 . . . . 0.0 109.291 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -143.36 152.75 41.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -84.24 -1.52 55.35 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.869 1.668 . . . . 0.0 112.804 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.2 t -162.32 109.73 1.33 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.337 1.855 . . . . 0.0 110.971 176.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.4 ttp85 -67.17 106.5 2.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 120.459 -1.401 . . . . 0.0 110.556 172.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.35 3.05 13.3 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.129 1.372 . . . . 0.0 113.036 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 13.8 p -74.64 147.26 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.775 1.23 . . . . 0.0 113.168 -174.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -132.03 2.13 3.95 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.2 1.8 . . . . 0.0 113.266 174.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 93.8 m 45.66 54.31 7.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.447 2.299 . . . . 0.0 113.346 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -152.89 -29.88 0.14 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.372 2.669 . . . . 0.0 111.751 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -108.94 -4.06 17.04 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.77 1.628 . . . . 0.0 114.136 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.9 pt -61.98 -7.74 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.9 tpt -52.46 -27.8 17.59 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.277 1.431 . . . . 0.0 113.823 169.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 99.9 p -90.45 -5.14 56.44 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 p -100.43 -179.39 4.09 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.715 1.606 . . . . 0.0 111.695 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -68.92 -15.51 63.51 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.93 5.77 18.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.319 1.848 . . . . 0.0 114.849 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -63.14 -8.19 7.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.939 2.496 . . . . 0.0 115.207 -174.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -62.07 -5.68 2.4 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.446 1.898 . . . . 0.0 114.719 -173.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 43.5 t 47.18 45.88 16.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.923 1.689 . . . . 0.0 112.69 -170.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 157.33 21.82 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.876 1.27 . . . . 0.0 111.656 167.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -63.87 -34.22 77.45 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.659 1.184 . . . . 0.0 113.993 -171.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 9.7 ptmm? -163.04 158.9 22.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.069 1.748 . . . . 0.0 111.77 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -134.02 122.33 22.86 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.638 1.175 . . . . 0.0 110.105 173.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -88.16 92.73 9.26 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.149 0.579 . . . . 0.0 110.047 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -78.66 126.05 30.2 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.884 -0.51 . . . . 0.0 111.253 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -99.12 115.57 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.833 1.253 . . . . 0.0 108.091 171.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -88.68 87.37 7.23 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.904 -0.497 . . . . 0.0 110.005 167.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.8 t -151.39 171.07 18.07 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.267 1.027 . . . . 0.0 112.998 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.6 mtp-105 -74.64 163.62 67.01 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 126.376 1.871 . . . . 0.0 110.934 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.84 -24.08 25.13 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.24 1.96 . . . . 0.0 114.393 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.54 -57.12 27.08 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.92 1.288 . . . . 0.0 112.95 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.37 -1.06 8.36 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.194 2.596 . . . . 0.0 114.602 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -99.72 -54.62 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 126.291 1.836 . . . . 0.0 109.665 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -44.96 77.61 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.41 -0.806 . . . . 0.0 112.843 -178.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.76 -4.11 38.64 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -172.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.4 mt -53.72 -35.56 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.702 0.801 . . . . 0.0 110.654 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.69 157.84 19.29 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.842 1.257 . . . . 0.0 113.196 172.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -155.45 109.26 2.83 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.985 1.714 . . . . 0.0 110.373 177.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.05 2.41 88.25 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.57 1.081 . . . . 0.0 114.909 -178.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.9 mt -76.23 118.92 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.752 1.221 . . . . 0.0 111.223 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -113.27 -9.7 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 126.887 2.075 . . . . 0.0 110.863 173.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.4 7.72 3.34 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.517 2.327 . . . . 0.0 116.01 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 79.4 p 50.24 61.8 3.01 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.711 1.605 . . . . 0.0 113.909 -173.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -156.14 155.99 33.47 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.576 1.551 . . . . 0.0 110.952 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -138.65 -171.81 3.15 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.959 -1.088 . . . . 0.0 111.106 166.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.4 t -124.87 142.34 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.294 1.437 . . . . 0.0 108.583 173.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.1 tp -47.97 137.4 10.19 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.241 1.016 . . . . 0.0 111.99 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.88 171.95 1.93 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.618 0.767 . . . . 0.0 112.293 175.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.6 t -118.27 -25.61 6.54 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.401 1.081 . . . . 0.0 113.835 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.1 m -82.4 169.81 16.01 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.655 1.182 . . . . 0.0 111.989 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -116.76 103.56 10.47 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.281 1.032 . . . . 0.0 111.4 -175.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -98.33 162.12 13.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.75 1.62 . . . . 0.0 110.96 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.64 105.81 4.41 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.918 -0.489 . . . . 0.0 110.122 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -97.93 124.62 42.45 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.615 1.166 . . . . 0.0 111.642 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.1 t -125.62 95.08 4.32 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 125.647 1.579 . . . . 0.0 110.05 -172.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.97 138.65 31.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.961 1.304 . . . . 0.0 110.506 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 43.3 m -113.32 151.4 31.24 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.95 -1.094 . . . . 0.0 108.481 161.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -135.57 123.65 22.91 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.811 0.844 . . . . 0.0 109.391 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.1 t -57.05 146.23 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.648 0.779 . . . . 0.0 111.483 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -135.65 103.63 5.5 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.235 1.014 . . . . 0.0 111.666 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.253 1.285 0 C-N-CA 126.693 1.997 . . . . 0.0 111.426 179.671 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo . . . . . 0 CA--C 1.538 0.716 0 N-CA-C 113.305 0.463 . . . . 0.0 113.305 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.4 m -136.92 -167.89 2.17 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.692 2.397 . . . . 0.0 109.352 175.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.12 146.97 43.76 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.565 1.146 . . . . 0.0 109.327 168.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -141.51 161.31 38.22 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.456 1.502 . . . . 0.0 110.423 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -105.42 158.04 16.93 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.031 1.332 . . . . 0.0 113.766 177.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.72 110.9 18.17 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.701 2.0 . . . . 0.0 111.466 -171.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -134.98 98.43 4.01 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.086 1.354 . . . . 0.0 112.234 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -116.5 137.27 52.3 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.398 1.479 . . . . 0.0 111.171 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 72.9 m -145.94 167.44 23.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.141 1.776 . . . . 0.0 111.027 -175.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 m -140.3 104.53 4.81 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.289 -0.882 . . . . 0.0 111.24 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.86 171.82 5.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.937 1.295 . . . . 0.0 113.252 -170.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 172.73 1.62 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 128.788 2.835 . . . . 0.0 113.658 168.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -143.46 145.33 32.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.569 1.948 . . . . 0.0 111.643 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.3 t -105.36 139.33 40.16 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.023 0.929 . . . . 0.0 111.277 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.9 m -146.88 -178.93 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.306 1.842 . . . . 0.0 111.335 -173.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.2 m -127.03 116.02 20.09 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.688 1.195 . . . . 0.0 111.552 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -85.45 131.57 34.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.345 0.658 . . . . 0.0 111.616 173.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.84 115.45 10.62 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.22 1.408 . . . . 0.0 108.55 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 58.6 54.98 5.05 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.958 1.303 . . . . 0.0 112.335 -170.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 65.03 25.54 12.63 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.493 2.317 . . . . 0.0 115.077 169.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.6 133.08 5.73 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.962 1.305 . . . . 0.0 109.653 -175.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -75.91 108.55 2.71 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.803 3.002 . . . . 0.0 112.984 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.8 m -111.01 15.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 126.169 1.788 . . . . 0.0 113.044 -178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.4 143.67 24.07 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.139 1.336 . . . . 0.0 111.086 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -102.39 126.78 49.52 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.677 1.191 . . . . 0.0 111.407 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.6 t -101.68 -56.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.903 0.881 . . . . 0.0 111.852 -178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.27 -171.78 41.15 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 -170.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 t -131.26 120.39 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.005 1.722 . . . . 0.0 110.168 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.27 2.29 25.34 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.579 0.992 . . . . 0.0 115.579 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.4 p -170.28 166.86 8.68 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.895 2.478 . . . . 0.0 111.079 -176.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.8 m . . . . . 0 CA--C 1.544 0.716 0 C-N-CA 125.539 1.536 . . . . 0.0 110.996 173.486 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.9 t70 . . . . . 0 CA--C 1.54 0.578 0 CA-C-O 121.688 0.756 . . . . 0.0 109.279 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.0 t-105 -54.19 -36.97 63.99 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.585 1.554 . . . . 0.0 112.293 166.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -44.41 92.02 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.901 0.881 . . . . 0.0 111.491 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.6 p -84.97 -26.05 27.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.297 1.039 . . . . 0.0 113.771 176.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -52.47 -42.3 64.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.785 1.634 . . . . 0.0 112.996 173.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -57.62 -62.54 1.72 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.056 0.942 . . . . 0.0 110.475 172.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.22 -22.13 50.73 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -67.65 -55.23 14.09 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.186 1.795 . . . . 0.0 112.44 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -146.52 22.27 1.31 Allowed 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -173.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -126.78 147.84 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 O-C-N 120.473 -1.392 . . . . 0.0 109.006 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.8 t -143.05 152.08 41.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -83.27 -1.5 53.32 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.838 1.655 . . . . 0.0 112.779 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.9 t -163.26 107.48 1.05 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.204 1.802 . . . . 0.0 111.429 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -67.92 110.54 3.91 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.376 -1.453 . . . . 0.0 110.42 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -129.33 7.71 5.42 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.603 1.561 . . . . 0.0 113.088 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.5 t -75.68 141.35 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.804 1.241 . . . . 0.0 111.983 -172.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -126.3 4.99 7.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.075 1.75 . . . . 0.0 113.437 -178.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.0 m 55.07 40.12 31.8 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 126.957 2.103 . . . . 0.0 114.26 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -152.16 -26.23 0.18 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.084 2.154 . . . . 0.0 113.432 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -99.61 -5.24 29.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.63 1.172 . . . . 0.0 113.482 176.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -64.53 -5.07 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.939 1.296 . . . . 0.0 114.435 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -53.5 -25.93 18.66 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 160.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.3 t -97.54 -15.84 20.35 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.708 1.603 . . . . 0.0 113.844 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 49.3 p -94.75 -179.81 4.99 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.014 1.326 . . . . 0.0 110.94 175.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -68.43 -11.19 59.35 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -85.52 12.54 8.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.548 2.339 . . . . 0.0 114.811 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 36.5 p90 -67.21 -8.77 34.06 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.061 2.144 . . . . 0.0 114.76 -171.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -62.59 -6.64 3.67 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.445 2.298 . . . . 0.0 115.384 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.0 t 40.55 56.02 2.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.513 1.925 . . . . 0.0 112.949 -165.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 158.87 28.17 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.223 1.409 . . . . 0.0 111.61 167.344 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.82 -35.48 80.8 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -172.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -160.4 156.53 26.27 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.097 1.759 . . . . 0.0 111.564 170.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -131.34 129.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.775 1.23 . . . . 0.0 109.61 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.0 m -96.83 93.84 6.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.691 0.796 . . . . 0.0 109.68 177.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -77.89 127.86 33.04 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.529 0.732 . . . . 0.0 111.394 175.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.6 mt -105.77 114.2 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.985 1.714 . . . . 0.0 107.901 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -86.35 84.2 7.51 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.822 -0.549 . . . . 0.0 110.479 170.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.8 m -141.88 158.29 43.97 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.611 1.565 . . . . 0.0 112.665 178.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -72.41 161.48 78.86 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.898 1.279 . . . . 0.0 110.762 164.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.8 -21.58 28.47 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.401 2.067 . . . . 0.0 114.375 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -61.5 -58.11 20.7 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 119.551 1.069 . . . . 0.0 112.572 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.37 0.41 5.39 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.148 2.565 . . . . 0.0 115.039 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -103.61 -54.96 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.336 1.854 . . . . 0.0 109.747 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -44.47 78.88 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.112 -0.993 . . . . 0.0 112.884 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.11 32.98 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.509 1.299 . . . . 0.0 114.509 -173.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.2 mt -52.61 -35.95 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.622 0.769 . . . . 0.0 110.645 169.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.8 p -109.8 159.99 16.72 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.286 1.034 . . . . 0.0 113.277 174.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 tptp -155.11 107.2 2.68 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.694 1.598 . . . . 0.0 110.567 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 6.29 88.67 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.275 0.941 . . . . 0.0 114.898 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.1 mt -76.56 115.39 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.518 1.159 . . . . 0.0 110.952 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 mt -112.33 -10.59 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 126.833 2.053 . . . . 0.0 110.893 173.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.96 3.79 6.32 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.406 2.282 . . . . 0.0 115.72 -173.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.1 t 53.44 66.2 1.3 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.819 1.647 . . . . 0.0 113.013 -173.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -156.46 160.53 39.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.281 1.832 . . . . 0.0 111.298 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -142.31 -169.73 3.02 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.693 -1.254 . . . . 0.0 111.733 164.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.5 t -125.08 139.68 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.652 1.581 . . . . 0.0 108.783 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.9 tp -49.53 139.71 11.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.743 1.217 . . . . 0.0 111.836 170.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.1 172.28 1.47 Allowed 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 174.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.1 t -122.49 -30.36 3.94 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.93 1.292 . . . . 0.0 113.802 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.5 m -75.63 169.89 17.23 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.546 1.138 . . . . 0.0 111.648 171.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -123.7 105.03 9.36 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.991 0.916 . . . . 0.0 111.524 -173.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -100.28 163.76 12.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.622 1.969 . . . . 0.0 110.835 -171.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -73.86 104.16 4.64 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.724 -0.61 . . . . 0.0 110.411 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.07 131.0 44.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.089 1.355 . . . . 0.0 111.892 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.6 t -135.84 96.8 3.49 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.156 1.382 . . . . 0.0 110.801 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -93.6 155.03 17.52 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.706 0.765 . . . . 0.0 111.77 171.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.08 99.24 3.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.594 0.757 . . . . 0.0 110.979 171.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -86.59 133.05 33.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.74 1.216 . . . . 0.0 111.2 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.98 147.79 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 C-N-CA 125.075 1.35 . . . . 0.0 111.933 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 76.5 p -120.89 96.21 5.02 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.065 1.346 . . . . 0.0 111.536 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.456 1.502 . . . . 0.0 112.762 176.479 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.539 0.746 0 N-CA-C 112.881 0.3 . . . . 0.0 112.881 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.0 m -141.63 168.33 20.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.157 2.183 . . . . 0.0 110.064 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -87.97 137.55 32.23 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.767 1.227 . . . . 0.0 109.997 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -137.17 160.86 37.77 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.694 1.198 . . . . 0.0 112.29 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -96.15 155.31 16.81 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.635 2.374 . . . . 0.0 111.447 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tp -80.34 127.89 32.92 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.674 1.19 . . . . 0.0 111.352 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -147.33 96.86 2.77 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.335 1.454 . . . . 0.0 112.006 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 mmtm -100.55 149.12 24.05 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.193 1.397 . . . . 0.0 111.208 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 29.6 m -155.89 169.0 25.44 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.203 1.801 . . . . 0.0 111.152 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 m -141.17 105.27 4.79 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.293 -0.88 . . . . 0.0 110.867 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.28 172.09 6.39 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.778 1.231 . . . . 0.0 113.652 -171.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.78 174.24 0.63 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 128.241 2.616 . . . . 0.0 114.515 168.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.79 143.77 31.5 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.878 2.071 . . . . 0.0 111.702 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 t -102.99 140.23 37.52 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.569 1.148 . . . . 0.0 111.095 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -147.18 -179.94 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 125.926 1.69 . . . . 0.0 111.711 -175.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 m -125.56 117.78 24.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.828 1.251 . . . . 0.0 111.583 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.81 131.52 34.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.625 0.77 . . . . 0.0 111.517 173.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -135.21 115.93 13.89 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.69 1.596 . . . . 0.0 108.437 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 56.47 55.82 6.2 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.688 1.195 . . . . 0.0 112.416 -171.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.59 24.83 11.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.551 2.34 . . . . 0.0 114.936 169.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -155.54 131.26 5.51 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.485 1.114 . . . . 0.0 109.567 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -76.29 102.32 1.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.975 3.116 . . . . 0.0 112.046 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.7 m -90.44 -10.21 10.23 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.583 0 CA-C-O 117.728 -1.129 . . . . 0.0 112.494 -179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -138.58 133.3 32.33 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.657 1.571 . . . . 0.0 111.041 -163.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -82.93 144.81 29.77 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.288 0.495 . . . . 0.0 110.168 171.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -116.31 -51.78 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.831 0.853 . . . . 0.0 111.652 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.81 -177.23 47.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 123.564 0.602 . . . . 0.0 113.018 -176.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -124.56 133.3 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.522 1.129 . . . . 0.0 111.494 -174.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.7 -6.58 6.11 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.551 1.072 . . . . 0.0 115.616 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -173.6 169.04 4.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.538 3.135 . . . . 0.0 109.201 -168.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.6 m . . . . . 0 CA--C 1.539 0.546 0 C-N-CA 125.592 1.557 . . . . 0.0 110.683 173.16 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 122.554 1.169 . . . . 0.0 111.889 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.6 t-105 -50.27 -37.25 35.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.044 1.738 . . . . 0.0 111.813 162.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -27.21 64.48 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.471 1.508 . . . . 0.0 113.019 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.2 p -106.78 -20.5 13.32 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.837 1.655 . . . . 0.0 113.942 174.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -51.3 -40.97 60.14 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.136 1.774 . . . . 0.0 112.557 171.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -58.13 -65.21 0.68 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.779 1.232 . . . . 0.0 110.519 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.01 -21.76 63.9 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -177.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -63.14 -48.04 80.17 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.1 1.76 . . . . 0.0 113.674 174.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -154.39 21.25 0.48 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 115.759 1.762 . . . . 0.0 115.759 -175.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.5 mt -128.47 147.3 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.354 1.461 . . . . 0.0 109.386 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -144.71 154.48 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 176.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -86.63 0.44 54.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.076 1.75 . . . . 0.0 112.591 167.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.67 109.88 1.27 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.443 1.897 . . . . 0.0 111.279 176.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 ttp85 -66.96 104.49 1.39 Allowed 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.473 -1.392 . . . . 0.0 110.304 171.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -114.79 5.7 15.31 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.833 1.653 . . . . 0.0 112.677 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 85.7 t -81.73 139.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.241 1.016 . . . . 0.0 111.454 -173.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -126.37 8.07 7.11 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.201 1.8 . . . . 0.0 112.539 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 28.3 m 53.33 40.9 32.0 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.27 2.228 . . . . 0.0 113.487 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -153.16 -26.44 0.15 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 127.818 2.447 . . . . 0.0 112.851 178.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -99.43 -5.11 30.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.746 1.218 . . . . 0.0 113.808 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -63.98 -8.24 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.837 1.255 . . . . 0.0 114.136 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.2 tmm? -55.71 -31.01 62.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.152 0.981 . . . . 0.0 112.677 163.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.5 m -88.98 -9.16 52.44 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.572 1.549 . . . . 0.0 114.671 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.4 p -106.14 179.15 4.35 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.261 1.425 . . . . 0.0 111.218 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -65.61 -15.59 62.89 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.551 -1.343 . . . . 0.0 114.097 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.9 7.52 8.7 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 127.42 2.288 . . . . 0.0 114.694 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -63.79 -8.06 9.62 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.126 2.171 . . . . 0.0 115.093 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 58.7 t60 -61.29 -10.74 7.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.217 1.807 . . . . 0.0 114.796 -174.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.1 t 39.55 62.45 1.18 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.968 2.107 . . . . 0.0 113.249 -165.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 159.97 32.02 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.741 161.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.54 -31.32 72.32 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.36 1.464 . . . . 0.0 114.625 -171.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.6 ptmm? -160.4 156.49 26.22 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.576 1.55 . . . . 0.0 111.541 168.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -128.22 149.28 50.53 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.857 0.863 . . . . 0.0 110.231 168.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.9 m -115.33 91.8 3.72 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.049 0.94 . . . . 0.0 109.769 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -80.25 128.12 33.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.278 0.561 . . . . 0.0 111.266 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 82.6 mt -105.93 113.69 43.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.001 1.721 . . . . 0.0 107.432 176.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -84.24 89.08 7.27 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.676 -0.64 . . . . 0.0 110.022 168.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 64.3 p -149.07 164.49 34.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.511 1.124 . . . . 0.0 112.811 171.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -76.45 161.77 73.39 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.701 1.2 . . . . 0.0 110.611 171.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -68.99 -21.35 37.2 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.028 1.819 . . . . 0.0 114.563 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.95 -57.38 21.67 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 119.483 1.038 . . . . 0.0 113.015 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.2 -0.46 5.69 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.446 2.764 . . . . 0.0 115.157 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -101.41 -56.42 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 109.577 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.04 -43.76 86.62 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.229 -0.919 . . . . 0.0 113.031 -179.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.93 -3.28 34.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 64.5 mt -53.5 -35.8 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.529 0.732 . . . . 0.0 110.615 170.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.0 p -109.02 159.26 16.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.284 1.034 . . . . 0.0 113.262 174.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -153.91 102.07 2.48 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.845 1.658 . . . . 0.0 110.577 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.85 5.47 87.91 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.175 0.893 . . . . 0.0 114.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.8 mt -73.82 115.68 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-N 118.635 1.217 . . . . 0.0 111.177 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -109.42 -12.1 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 126.614 1.966 . . . . 0.0 110.809 171.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.15 5.68 4.18 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.477 2.311 . . . . 0.0 116.217 -170.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.0 t 52.38 64.87 1.69 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.446 1.498 . . . . 0.0 112.741 -173.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -156.13 158.05 37.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 126.279 1.832 . . . . 0.0 111.058 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -144.34 -169.59 3.17 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.747 -1.22 . . . . 0.0 111.839 163.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.84 141.37 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 125.681 1.592 . . . . 0.0 108.735 171.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.2 tp -50.73 141.6 12.69 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.682 1.193 . . . . 0.0 111.889 170.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.58 171.49 1.98 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 173.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -122.4 -20.46 6.09 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.804 1.242 . . . . 0.0 114.017 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 41.1 m -83.96 170.37 14.06 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.07 1.348 . . . . 0.0 111.63 174.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -117.57 106.02 12.68 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.576 1.151 . . . . 0.0 111.023 -178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -98.93 159.2 15.12 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.714 1.606 . . . . 0.0 110.341 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -70.52 106.94 3.63 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.944 -0.472 . . . . 0.0 110.232 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.48 132.31 44.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.952 1.301 . . . . 0.0 111.789 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.4 t -136.11 93.57 2.93 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.746 1.219 . . . . 0.0 109.87 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.8 159.28 17.82 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.733 0.813 . . . . 0.0 110.488 171.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.07 139.79 29.13 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.257 1.023 . . . . 0.0 109.371 161.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -124.13 125.94 45.34 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.545 1.138 . . . . 0.0 110.573 -174.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.07 145.34 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.561 0.744 . . . . 0.0 111.634 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.2 t -135.9 105.69 6.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.471 1.108 . . . . 0.0 111.453 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.6 t . . . . . 0 C--O 1.254 1.33 0 C-N-CA 126.539 1.936 . . . . 0.0 111.56 -179.402 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo . . . . . 0 CA--C 1.544 0.982 0 N-CA-C 114.126 0.779 . . . . 0.0 114.126 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 m -135.18 165.97 24.18 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.804 2.042 . . . . 0.0 109.817 171.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.6 mmpt? -95.34 142.74 27.37 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.942 0.897 . . . . 0.0 110.983 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -136.91 156.14 48.85 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.509 1.524 . . . . 0.0 110.995 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.97 151.64 19.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.17 1.388 . . . . 0.0 112.302 172.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.6 110.31 16.85 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.743 2.017 . . . . 0.0 111.372 -174.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -130.36 116.97 19.04 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.544 1.537 . . . . 0.0 111.466 175.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -130.35 150.43 51.59 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.968 1.707 . . . . 0.0 110.835 174.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.8 m -156.69 173.9 16.27 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.198 1.799 . . . . 0.0 111.43 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -144.27 101.49 3.71 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.067 -1.021 . . . . 0.0 110.861 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.13 175.8 8.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.192 1.397 . . . . 0.0 113.108 -176.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.21 170.02 5.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.162 2.585 . . . . 0.0 113.276 172.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -140.37 143.76 35.89 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.736 1.614 . . . . 0.0 111.811 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.7 t -102.21 143.99 31.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.916 0.865 . . . . 0.0 111.232 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -147.5 -178.05 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.455 1.902 . . . . 0.0 111.597 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.3 m -126.91 115.4 19.22 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.768 1.227 . . . . 0.0 111.612 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.9 t -83.29 129.87 35.03 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.113 0.965 . . . . 0.0 111.497 176.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.11 113.0 8.13 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.51 1.124 . . . . 0.0 108.538 177.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.7 59.46 3.22 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.522 1.529 . . . . 0.0 113.025 -169.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 62.84 26.46 15.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.599 2.359 . . . . 0.0 114.8 169.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.43 134.7 5.8 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 125.317 1.447 . . . . 0.0 109.559 -176.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.41 107.97 2.6 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.644 2.896 . . . . 0.0 113.072 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.9 m -108.31 17.58 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.777 2.031 . . . . 0.0 112.603 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -153.27 140.53 19.52 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.137 1.335 . . . . 0.0 110.589 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -86.07 148.2 25.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.928 0.491 . . . . 0.0 110.387 170.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.4 t -119.0 -58.8 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 123.675 0.79 . . . . 0.0 111.771 173.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.86 -172.3 42.18 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-N 118.537 0.608 . . . . 0.0 114.089 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.2 t -128.77 123.99 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.179 1.392 . . . . 0.0 109.891 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.3 3.49 25.2 Favored Glycine 0 CA--C 1.541 1.713 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -175.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 99.0 p -165.87 164.89 18.55 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.15 2.18 . . . . 0.0 111.42 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 93.1 m . . . . . 0 CA--C 1.54 0.575 0 C-N-CA 125.631 1.572 . . . . 0.0 110.611 171.942 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 CA--C 1.542 0.643 0 CA-C-O 121.989 0.899 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.2 t-105 -55.07 -36.64 65.83 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.142 1.777 . . . . 0.0 112.185 169.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.88 -37.34 76.35 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.866 1.266 . . . . 0.0 112.195 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 p -89.47 -27.91 20.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.542 1.137 . . . . 0.0 113.521 174.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -52.05 -44.4 64.25 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.787 1.635 . . . . 0.0 113.067 174.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -56.02 -63.06 1.3 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -60.36 -20.01 57.83 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -70.11 -46.87 63.9 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.123 1.369 . . . . 0.0 113.311 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -153.04 23.65 0.56 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -176.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.4 mt -128.62 147.8 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 120.147 -1.596 . . . . 0.0 109.299 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -147.78 155.68 41.94 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 177.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.07 2.31 54.27 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.255 1.822 . . . . 0.0 112.814 167.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.1 t -160.18 114.41 2.22 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.185 1.794 . . . . 0.0 111.23 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.9 ttp-105 -66.47 103.21 1.0 Allowed 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.669 -1.27 . . . . 0.0 110.45 172.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -112.83 2.89 16.12 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.059 1.344 . . . . 0.0 113.45 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.2 p -75.54 145.06 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.355 1.062 . . . . 0.0 112.398 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -130.32 8.08 5.03 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.112 1.765 . . . . 0.0 112.703 172.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 21.4 m 48.37 50.85 16.04 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.895 2.478 . . . . 0.0 113.238 -176.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.43 -17.01 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.366 2.266 . . . . 0.0 113.202 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -110.26 -2.99 16.49 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.936 1.695 . . . . 0.0 113.767 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -63.98 -8.66 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.637 1.575 . . . . 0.0 113.913 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 ppp? -53.01 -22.51 5.83 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.8 t -98.07 -21.26 16.88 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.487 1.515 . . . . 0.0 113.995 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.1 p -87.35 -177.7 6.01 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 111.849 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -63.22 -20.53 65.51 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.832 -1.168 . . . . 0.0 113.646 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.79 21.81 3.39 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.569 1.948 . . . . 0.0 113.326 -175.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -63.6 -7.03 6.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 126.092 1.757 . . . . 0.0 114.663 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 66.0 t60 -64.7 -6.46 7.92 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.583 1.553 . . . . 0.0 114.653 -177.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.31 33.6 18.72 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.187 1.795 . . . . 0.0 114.476 -177.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 158.18 3.52 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.061 1.745 . . . . 0.0 113.926 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.04 -35.69 81.07 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.435 1.494 . . . . 0.0 114.877 -173.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -161.18 163.44 31.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.185 1.394 . . . . 0.0 112.774 165.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -131.63 166.18 22.02 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.979 0.912 . . . . 0.0 111.336 166.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.0 m -126.73 93.84 3.89 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.734 1.214 . . . . 0.0 109.404 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -77.95 122.64 25.78 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.259 0.624 . . . . 0.0 110.759 174.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -98.64 114.52 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.954 1.302 . . . . 0.0 107.848 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -87.02 86.1 7.29 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.386 0.612 . . . . 0.0 110.122 167.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.5 p -145.87 166.66 25.31 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.897 1.279 . . . . 0.0 112.205 168.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -73.29 164.47 60.73 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.406 1.082 . . . . 0.0 111.325 168.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.91 -23.19 25.83 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.747 2.298 . . . . 0.0 114.521 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -59.57 -58.49 19.09 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.61 1.164 . . . . 0.0 112.806 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.56 0.73 5.08 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.307 2.671 . . . . 0.0 114.926 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.6 t -103.3 -55.57 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 126.604 1.962 . . . . 0.0 109.82 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -43.07 85.11 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.208 -0.933 . . . . 0.0 112.769 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.64 -5.58 46.18 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -173.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.5 mt -53.49 -36.01 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.598 0.759 . . . . 0.0 110.58 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 p -111.5 158.44 19.16 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.805 1.242 . . . . 0.0 113.057 173.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -155.77 105.97 2.44 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.742 1.617 . . . . 0.0 110.579 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.35 5.62 86.94 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 123.984 0.802 . . . . 0.0 114.733 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.4 mt -77.45 116.53 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.676 1.19 . . . . 0.0 110.87 -178.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 7.5 mt -111.33 -12.52 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 126.768 2.027 . . . . 0.0 110.879 175.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.32 7.67 2.68 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 127.633 2.373 . . . . 0.0 116.095 -170.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.9 t 49.69 66.11 1.22 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.996 1.318 . . . . 0.0 113.276 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.1 tttt -159.37 157.46 30.39 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.352 1.461 . . . . 0.0 111.356 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -145.01 -169.11 3.11 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.576 -1.327 . . . . 0.0 112.067 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 16.8 t -125.74 143.2 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 126.127 1.771 . . . . 0.0 108.865 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.5 tp -50.78 141.91 12.32 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.559 1.143 . . . . 0.0 111.982 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.94 172.9 1.53 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 8.8 t -120.37 -28.85 4.93 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.799 1.24 . . . . 0.0 113.573 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.9 m -76.96 171.7 14.37 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.419 1.488 . . . . 0.0 111.845 173.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -123.04 110.4 15.29 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.118 0.967 . . . . 0.0 111.144 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -105.98 159.67 15.87 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.157 1.783 . . . . 0.0 110.245 -171.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.64 109.54 4.38 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.337 0.589 . . . . 0.0 110.513 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.03 123.18 44.81 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.283 1.433 . . . . 0.0 111.231 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.9 t -126.71 93.61 3.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.436 1.494 . . . . 0.0 110.686 -173.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.02 163.45 16.28 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.463 0.649 . . . . 0.0 110.329 173.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.96 138.77 19.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 158.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -126.74 134.6 50.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.931 1.292 . . . . 0.0 109.271 -175.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 29.2 t -60.9 149.93 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 123.556 0.742 . . . . 0.0 111.816 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -134.52 106.64 7.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.22 1.408 . . . . 0.0 110.933 171.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.253 1.262 0 C-N-CA 126.244 1.818 . . . . 0.0 112.602 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 CA--C 1.54 0.825 0 N-CA-C 111.521 -0.223 . . . . 0.0 111.521 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -145.84 179.28 7.57 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.61 2.364 . . . . 0.0 109.574 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -110.16 131.16 55.31 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.644 1.178 . . . . 0.0 110.733 -177.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.84 161.94 33.79 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.222 1.409 . . . . 0.0 111.924 -176.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -107.55 151.13 26.01 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.002 1.721 . . . . 0.0 112.764 177.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.74 113.36 16.75 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.555 1.942 . . . . 0.0 111.487 -172.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -139.55 109.45 6.36 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.39 1.476 . . . . 0.0 111.883 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -118.12 153.81 33.17 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.417 1.487 . . . . 0.0 111.637 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.0 m -156.21 172.19 18.89 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.17 1.788 . . . . 0.0 111.557 175.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 m -141.26 104.91 4.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.869 0.868 . . . . 0.0 110.569 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.42 172.43 7.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.682 1.193 . . . . 0.0 113.664 -170.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.79 174.28 0.85 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.271 2.628 . . . . 0.0 114.397 167.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.01 147.06 32.21 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.682 1.993 . . . . 0.0 111.726 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 t -108.37 134.94 50.48 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.869 1.268 . . . . 0.0 111.404 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.3 m -141.79 -178.68 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.935 1.694 . . . . 0.0 111.707 -173.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.1 m -129.86 115.04 16.66 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.457 -0.777 . . . . 0.0 111.785 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.3 t -83.0 128.54 34.57 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.53 1.132 . . . . 0.0 111.254 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.23 112.16 8.42 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.682 1.193 . . . . 0.0 108.45 177.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 56.05 60.52 3.18 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.61 1.564 . . . . 0.0 112.968 -169.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.46 27.06 15.08 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.719 2.408 . . . . 0.0 114.751 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.17 133.8 5.45 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 109.519 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -75.86 105.12 2.02 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.809 3.006 . . . . 0.0 112.137 177.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 m -97.84 14.33 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.834 1.254 . . . . 0.0 111.997 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.7 t-80 -158.42 147.73 19.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.328 1.422 . . . . 0.0 113.025 -167.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -108.77 128.0 54.5 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.007 1.323 . . . . 0.0 111.009 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.4 t -93.66 -58.24 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.027 0.931 . . . . 0.0 110.97 174.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.77 -175.58 46.62 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.448 1.023 . . . . 0.0 112.652 -172.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.9 p -122.79 136.86 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.43 1.092 . . . . 0.0 111.84 -172.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.96 -5.36 3.67 Favored Glycine 0 CA--C 1.541 1.714 0 N-CA-C 116.2 1.24 . . . . 0.0 116.2 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -172.5 165.46 5.65 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 129.929 3.292 . . . . 0.0 109.527 -171.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 83.9 m . . . . . 0 CA--C 1.542 0.653 0 C-N-CA 125.042 1.337 . . . . 0.0 110.427 173.7 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 . . . . . 0 CA--C 1.543 0.711 0 CA-C-O 123.026 1.393 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -56.78 -36.99 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.186 2.194 . . . . 0.0 112.215 167.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.47 90.4 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.699 1.2 . . . . 0.0 111.587 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.6 p -82.93 -29.3 29.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.099 1.36 . . . . 0.0 113.532 174.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.56 -43.87 65.5 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.389 1.476 . . . . 0.0 112.699 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.12 -61.58 2.36 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.12 0.968 . . . . 0.0 110.536 173.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.66 -19.86 52.27 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -178.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -70.32 -48.44 56.52 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.764 1.626 . . . . 0.0 112.986 175.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -152.34 22.85 0.63 Allowed 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.8 mt -128.08 144.16 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 120.439 -1.413 . . . . 0.0 109.534 178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.4 t -143.36 156.39 44.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 178.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -91.42 0.83 57.46 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.396 1.878 . . . . 0.0 112.487 167.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.3 t -162.8 112.29 1.38 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.338 1.855 . . . . 0.0 111.185 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.8 ttp-105 -68.0 107.34 2.65 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.545 -1.347 . . . . 0.0 110.673 173.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.47 1.57 13.68 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.142 1.377 . . . . 0.0 113.687 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.0 p -69.92 142.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.07 1.348 . . . . 0.0 112.516 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -130.96 12.16 5.17 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.268 1.827 . . . . 0.0 112.424 169.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.9 m 51.48 40.93 27.9 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.034 2.534 . . . . 0.0 113.152 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -153.25 -38.68 0.1 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.379 2.271 . . . . 0.0 111.362 -174.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -90.97 -8.3 49.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.369 1.067 . . . . 0.0 113.493 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.0 pt -62.15 -10.59 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.347 1.059 . . . . 0.0 113.721 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.83 -36.04 35.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.82 1.648 . . . . 0.0 113.451 166.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 96.0 p -87.3 -14.5 40.68 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 177.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.6 p -86.17 -178.84 6.61 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.221 1.408 . . . . 0.0 111.869 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -70.88 -12.43 61.54 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -85.93 10.02 15.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.031 2.132 . . . . 0.0 114.989 -176.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -67.49 -7.49 26.07 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 127.978 2.511 . . . . 0.0 114.605 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -61.79 0.54 0.35 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.237 2.615 . . . . 0.0 115.846 -174.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.6 t 56.15 30.96 17.38 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.233 1.813 . . . . 0.0 114.2 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.57 154.85 27.63 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.973 1.309 . . . . 0.0 112.616 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -63.96 -33.72 76.36 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.922 1.289 . . . . 0.0 114.322 -169.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.3 pttm -162.01 163.79 28.66 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.559 1.544 . . . . 0.0 111.901 166.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -132.94 159.31 40.34 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.574 0.749 . . . . 0.0 110.674 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.0 m -122.73 90.41 3.29 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.363 1.065 . . . . 0.0 110.332 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -77.42 119.93 21.72 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.638 0.775 . . . . 0.0 111.134 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.6 mt -96.08 112.92 29.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 125.645 1.578 . . . . 0.0 107.65 173.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -80.5 89.61 5.64 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.532 -0.73 . . . . 0.0 109.783 167.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.0 m -149.0 159.2 44.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.56 1.144 . . . . 0.0 112.981 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 25.8 mtt-85 -71.14 163.79 62.55 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 124.575 1.15 . . . . 0.0 111.115 164.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.59 -24.2 30.69 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 122.301 2.0 . . . . 0.0 114.201 176.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.61 -56.37 30.35 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 117.921 -1.038 . . . . 0.0 113.091 -175.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.79 -0.39 6.87 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.983 2.455 . . . . 0.0 114.826 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -102.9 -54.44 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.323 1.849 . . . . 0.0 109.749 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -45.53 78.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.209 -0.932 . . . . 0.0 112.848 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.56 35.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -172.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.09 -35.68 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 123.642 0.777 . . . . 0.0 110.599 169.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.3 p -111.07 157.42 20.0 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.864 1.266 . . . . 0.0 113.217 172.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -155.37 106.25 2.54 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.583 1.953 . . . . 0.0 109.875 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.6 3.24 86.49 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.39 0.995 . . . . 0.0 114.754 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.2 mt -76.12 116.05 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.706 1.202 . . . . 0.0 110.86 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 17.9 mt -105.54 -18.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 126.447 1.899 . . . . 0.0 110.807 173.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.12 8.87 1.12 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 128.095 2.558 . . . . 0.0 116.909 -166.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 8.7 t 50.7 62.08 2.89 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.895 1.225 . . . . 0.0 113.48 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -157.55 154.62 28.87 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 125.919 1.687 . . . . 0.0 111.242 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -138.09 -170.54 2.82 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.869 -1.145 . . . . 0.0 111.534 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.85 141.92 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 125.75 1.62 . . . . 0.0 108.524 173.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.6 tp -51.01 140.96 14.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.29 1.036 . . . . 0.0 111.72 169.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.58 170.85 2.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 122.583 1.183 . . . . 0.0 113.508 172.193 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.8 p -118.26 -30.89 5.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.567 1.947 . . . . 0.0 113.353 -176.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.5 m -80.52 171.08 15.5 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.711 1.604 . . . . 0.0 112.086 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -118.48 110.09 17.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.796 1.238 . . . . 0.0 111.164 -176.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -104.75 161.08 14.47 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.809 1.644 . . . . 0.0 110.374 -173.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -71.47 109.14 5.25 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.876 -0.515 . . . . 0.0 110.417 -179.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.28 126.62 48.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.668 1.187 . . . . 0.0 112.003 -176.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 30.1 t -128.76 91.48 3.23 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.326 1.45 . . . . 0.0 109.855 -174.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -82.21 161.85 22.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.851 0.834 . . . . 0.0 110.407 169.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.58 128.73 11.15 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.04 -1.037 . . . . 0.0 109.484 157.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -116.96 136.87 52.61 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.406 1.083 . . . . 0.0 110.114 -173.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 20.6 t -60.5 147.35 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-O 121.451 0.643 . . . . 0.0 112.043 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.8 t -137.64 101.8 4.58 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.049 1.34 . . . . 0.0 111.269 172.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.0 p . . . . . 0 C--O 1.254 1.305 0 C-N-CA 126.591 1.956 . . . . 0.0 114.403 178.93 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 CA--C 1.539 0.76 0 N-CA-C 113.522 0.547 . . . . 0.0 113.522 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.68 -167.34 2.11 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.752 2.421 . . . . 0.0 109.217 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.12 149.41 42.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.736 1.214 . . . . 0.0 109.845 167.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -142.73 159.08 42.93 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.888 1.675 . . . . 0.0 110.213 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -99.11 157.21 16.51 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.481 1.112 . . . . 0.0 113.061 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.95 103.35 14.59 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.367 1.467 . . . . 0.0 111.093 -169.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -127.98 114.72 17.49 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.457 1.503 . . . . 0.0 111.118 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -130.86 147.67 52.54 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.05 1.74 . . . . 0.0 110.865 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.6 t -151.11 170.3 19.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.842 1.657 . . . . 0.0 110.987 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.4 m -139.7 100.86 4.06 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.479 -0.763 . . . . 0.0 110.768 173.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.93 176.74 9.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.833 1.253 . . . . 0.0 113.519 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.25 170.3 3.87 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.471 2.308 . . . . 0.0 113.608 171.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.9 p90 -141.15 142.18 34.08 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.122 1.769 . . . . 0.0 111.541 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.5 t -100.52 142.71 31.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.801 0.81 . . . . 0.0 111.413 174.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.8 m -147.24 -178.3 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 126.564 1.945 . . . . 0.0 110.983 -178.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -126.49 117.37 22.74 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.93 1.292 . . . . 0.0 111.532 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -87.1 133.0 33.66 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.658 0.783 . . . . 0.0 111.704 174.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -139.89 113.63 8.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.261 1.425 . . . . 0.0 108.501 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 59.47 56.7 3.6 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.402 1.481 . . . . 0.0 112.416 -169.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.12 24.81 13.57 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.629 2.372 . . . . 0.0 115.1 169.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.1 132.7 5.32 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.855 1.262 . . . . 0.0 109.639 -174.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.45 109.05 2.79 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.565 2.843 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.0 m -108.52 18.2 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.692 1.997 . . . . 0.0 112.518 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -156.51 137.31 13.37 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.659 -1.276 . . . . 0.0 110.826 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -80.69 153.82 27.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.056 0.389 . . . . 0.0 110.452 167.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.9 -54.54 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.216 1.006 . . . . 0.0 112.155 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.45 -172.28 43.43 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.259 0.936 . . . . 0.0 114.677 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -125.91 129.04 72.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 125.413 1.485 . . . . 0.0 109.99 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.17 -4.58 4.56 Favored Glycine 0 CA--C 1.539 1.565 0 N-CA-C 116.664 1.426 . . . . 0.0 116.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.0 m -162.43 162.96 27.88 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.558 3.143 . . . . 0.0 109.869 -172.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 90.2 m . . . . . 0 CA--C 1.537 0.471 0 C-N-CA 125.212 1.405 . . . . 0.0 109.771 167.353 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 t0 . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 122.547 1.165 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -56.67 -36.57 69.74 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.481 1.912 . . . . 0.0 112.357 168.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -45.08 89.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.034 1.334 . . . . 0.0 111.413 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.2 p -80.43 -30.94 37.64 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.854 1.262 . . . . 0.0 113.427 173.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -53.49 -44.14 68.79 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.318 1.447 . . . . 0.0 113.131 177.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -53.45 -61.58 2.21 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.147 0.979 . . . . 0.0 110.421 172.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -59.29 -20.06 51.29 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -72.66 -52.7 14.25 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.155 1.782 . . . . 0.0 113.856 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -133.14 7.88 3.99 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -175.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.4 mt -127.5 147.5 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 120.541 -1.349 . . . . 0.0 110.108 -172.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 12.5 t -143.34 154.99 44.31 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 174.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -91.18 0.52 57.51 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.194 1.798 . . . . 0.0 112.359 168.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.45 114.3 2.14 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.196 1.799 . . . . 0.0 111.192 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -67.93 103.39 1.47 Allowed 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.563 -1.336 . . . . 0.0 110.506 172.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -113.56 4.85 16.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.447 1.499 . . . . 0.0 113.046 177.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.6 t -79.74 142.55 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.434 1.093 . . . . 0.0 111.47 -176.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -128.71 9.66 5.95 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.032 1.733 . . . . 0.0 112.504 175.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 15.8 m 52.49 44.34 30.08 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.52 2.328 . . . . 0.0 113.043 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.7 -25.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.992 2.117 . . . . 0.0 113.245 -177.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -101.05 -5.05 26.28 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.751 1.22 . . . . 0.0 113.717 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.3 pt -61.41 -11.96 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.89 1.276 . . . . 0.0 114.005 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -57.37 -28.9 63.58 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.832 0.853 . . . . 0.0 112.923 167.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 t -83.82 1.26 43.92 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.01 1.724 . . . . 0.0 114.234 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.0 p -117.4 -177.02 3.13 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.611 1.565 . . . . 0.0 111.882 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -63.48 -17.85 63.16 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.14 -0.975 . . . . 0.0 113.539 171.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.77 11.71 25.99 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.204 1.802 . . . . 0.0 114.199 -170.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -63.3 -8.84 9.49 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.789 2.435 . . . . 0.0 115.313 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -62.28 -10.11 9.96 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.082 1.753 . . . . 0.0 114.759 -173.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 46.1 t 39.66 59.01 1.93 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.994 2.117 . . . . 0.0 113.234 -166.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.88 161.13 27.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.888 1.275 . . . . 0.0 111.743 162.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.88 -34.06 77.1 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.198 1.399 . . . . 0.0 114.381 -172.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.9 ptmt -160.02 157.05 28.02 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.7 1.6 . . . . 0.0 111.889 167.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -121.44 152.89 38.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.551 0.74 . . . . 0.0 109.42 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.5 m -112.36 98.13 7.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.017 1.327 . . . . 0.0 108.035 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -82.05 136.33 35.23 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.593 -0.692 . . . . 0.0 111.873 176.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.5 mt -109.12 109.7 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 125.942 1.697 . . . . 0.0 107.029 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.34 89.23 6.56 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.536 -0.727 . . . . 0.0 109.456 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 m -149.52 160.21 43.66 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.972 1.309 . . . . 0.0 112.687 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -70.16 163.42 61.86 Favored Pre-proline 0 N--CA 1.47 0.546 0 C-N-CA 124.326 1.05 . . . . 0.0 111.187 164.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.35 -23.55 27.97 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.312 2.008 . . . . 0.0 114.229 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.27 -57.7 23.92 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.088 -177.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.74 0.62 5.36 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.062 2.508 . . . . 0.0 114.855 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.27 -54.65 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.522 1.929 . . . . 0.0 109.748 176.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -46.01 76.29 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.129 -0.982 . . . . 0.0 112.745 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.44 -3.08 31.81 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -172.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.5 mt -53.19 -36.39 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 123.558 0.743 . . . . 0.0 110.403 168.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -107.96 159.0 16.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.084 0.954 . . . . 0.0 113.409 174.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.95 106.69 2.87 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.438 1.895 . . . . 0.0 109.779 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.53 5.08 90.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 124.301 0.953 . . . . 0.0 114.987 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.6 mt -75.85 116.11 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.646 1.179 . . . . 0.0 111.226 -176.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -110.82 -10.94 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 126.577 1.951 . . . . 0.0 111.008 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.14 3.76 5.22 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.447 2.299 . . . . 0.0 116.061 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 52.98 64.46 1.85 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.695 1.598 . . . . 0.0 112.717 -172.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -155.79 158.81 38.75 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.816 2.046 . . . . 0.0 110.968 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -141.51 -167.56 2.45 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.715 -1.241 . . . . 0.0 111.469 163.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -124.51 145.7 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.331 1.452 . . . . 0.0 109.488 167.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -51.94 142.3 15.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.69 1.196 . . . . 0.0 111.944 168.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.22 172.77 2.28 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.7 t -122.66 -25.07 4.76 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.098 1.359 . . . . 0.0 113.931 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.3 m -80.52 170.93 15.69 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.76 1.224 . . . . 0.0 111.993 172.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -117.54 110.96 18.6 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.726 1.21 . . . . 0.0 111.348 -177.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -106.39 161.98 14.09 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.87 1.668 . . . . 0.0 110.603 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -71.57 108.01 4.73 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 121.745 -0.597 . . . . 0.0 110.297 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -99.89 119.21 37.85 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.594 1.558 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.1 t -122.43 97.33 5.41 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.038 1.335 . . . . 0.0 110.459 -171.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -93.52 163.03 13.73 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.512 0.725 . . . . 0.0 111.067 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.82 107.85 3.22 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.496 -0.753 . . . . 0.0 111.875 163.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -92.58 132.41 36.88 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.606 1.163 . . . . 0.0 111.215 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.0 t -56.72 148.07 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.509 1.523 . . . . 0.0 112.008 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.1 p -118.11 86.88 2.61 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.905 1.282 . . . . 0.0 111.684 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 32.2 p . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.833 1.653 . . . . 0.0 114.151 173.459 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 CA--C 1.539 0.749 0 CA-C-O 120.126 -0.031 . . . . 0.0 112.027 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 m -140.89 175.78 9.34 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.357 1.863 . . . . 0.0 110.417 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -97.42 130.07 44.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.522 1.129 . . . . 0.0 110.516 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -134.33 160.63 37.34 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.9 1.28 . . . . 0.0 112.205 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -109.57 153.14 24.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.536 1.934 . . . . 0.0 112.443 177.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.52 112.83 19.79 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.319 1.848 . . . . 0.0 111.727 -170.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -139.56 103.29 4.66 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.455 . . . . 0.0 112.275 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -124.32 149.82 46.15 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.316 1.046 . . . . 0.0 111.656 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.1 t -148.79 174.81 11.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.603 1.561 . . . . 0.0 111.9 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.1 m -140.45 102.87 4.43 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.032 0.933 . . . . 0.0 110.997 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.66 170.22 9.6 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.916 1.286 . . . . 0.0 113.45 -172.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 170.85 1.11 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.911 2.484 . . . . 0.0 113.617 168.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.22 147.65 35.19 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.369 1.868 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 t -106.1 141.91 36.68 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.063 0.945 . . . . 0.0 111.607 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.7 m -145.75 -179.4 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.175 1.79 . . . . 0.0 111.876 -175.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.3 m -127.17 118.55 24.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.144 0.978 . . . . 0.0 111.954 176.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.8 t -87.36 127.73 35.2 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.204 1.002 . . . . 0.0 111.794 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -135.58 114.72 12.3 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.057 1.343 . . . . 0.0 109.107 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 57.25 57.04 4.72 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 112.535 -172.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 64.33 26.66 13.67 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.468 2.307 . . . . 0.0 114.719 170.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.41 135.08 6.56 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.961 1.304 . . . . 0.0 109.548 -177.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.56 107.85 2.57 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.714 2.943 . . . . 0.0 112.564 177.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.9 m -100.76 6.46 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.495 1.518 . . . . 0.0 112.236 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -148.53 146.62 28.4 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.797 1.635 . . . . 0.0 112.592 -175.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -103.0 131.7 49.79 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.732 1.213 . . . . 0.0 111.108 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -104.52 -52.96 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.146 0.978 . . . . 0.0 112.084 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.62 -172.58 44.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 119.098 0.863 . . . . 0.0 114.924 -173.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.8 t -123.69 124.01 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.724 1.61 . . . . 0.0 110.354 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 65.78 3.62 16.41 Favored Glycine 0 CA--C 1.54 1.594 0 N-CA-C 115.864 1.105 . . . . 0.0 115.864 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.5 m -169.88 163.75 9.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 128.62 2.768 . . . . 0.0 110.382 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m . . . . . 0 CA--C 1.542 0.668 0 C-N-CA 125.574 1.55 . . . . 0.0 110.532 172.987 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 p30 . . . . . 0 CA--C 1.54 0.574 0 CA-C-O 123.429 1.585 . . . . 0.0 113.092 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -57.18 -33.7 67.72 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.181 2.192 . . . . 0.0 113.787 174.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.96 -46.13 89.19 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.097 -1.002 . . . . 0.0 110.62 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.2 p -76.9 -26.53 54.24 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 173.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -52.81 -46.01 67.51 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.57 1.548 . . . . 0.0 112.46 175.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -56.96 -60.66 3.25 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.072 0.949 . . . . 0.0 110.791 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.99 -24.94 60.22 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.37 -54.58 22.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.649 1.58 . . . . 0.0 114.047 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -146.9 20.22 1.27 Allowed 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.3 mt -126.72 150.19 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.063 1.345 . . . . 0.0 109.701 173.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 t -141.68 151.9 43.42 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -84.03 -3.71 58.22 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.604 1.562 . . . . 0.0 112.909 170.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.0 t -162.26 118.26 1.97 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.255 1.822 . . . . 0.0 110.991 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.9 ttp-105 -69.0 100.31 1.2 Allowed 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.515 -1.365 . . . . 0.0 111.389 174.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -107.52 4.18 25.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.568 1.547 . . . . 0.0 113.171 173.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.5 t -75.45 138.72 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.327 1.451 . . . . 0.0 111.426 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -126.68 4.56 6.74 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.794 1.638 . . . . 0.0 113.155 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.6 m 54.16 35.78 23.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.98 2.112 . . . . 0.0 113.321 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -153.52 -27.38 0.14 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.742 2.417 . . . . 0.0 112.513 -172.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -115.06 3.88 14.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.146 1.778 . . . . 0.0 114.27 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.9 pt -63.57 -8.33 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.219 1.407 . . . . 0.0 113.617 174.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.9 ttt -54.1 -28.15 37.55 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.955 1.302 . . . . 0.0 112.752 162.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 t -92.98 -0.7 57.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.153 1.781 . . . . 0.0 114.215 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.8 p -114.76 -175.59 2.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.385 1.474 . . . . 0.0 111.4 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -64.15 -15.91 60.78 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 120.935 -1.103 . . . . 0.0 113.711 176.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -100.28 17.72 20.66 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.167 1.787 . . . . 0.0 114.24 -164.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -68.85 -7.64 36.31 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 128.984 2.914 . . . . 0.0 114.682 -173.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -63.28 2.26 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 128.179 2.592 . . . . 0.0 115.817 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.2 t 56.79 27.92 13.57 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.263 1.825 . . . . 0.0 114.117 -176.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 154.93 17.68 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.131 1.372 . . . . 0.0 112.207 177.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.7 -33.97 77.21 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.9 ptmm? -161.37 160.03 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.905 1.682 . . . . 0.0 112.676 167.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -131.03 125.37 33.09 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.377 1.071 . . . . 0.0 109.766 163.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -87.64 95.2 9.97 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.546 1.138 . . . . 0.0 109.964 171.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -82.5 127.83 33.7 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.878 -0.514 . . . . 0.0 111.455 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 61.8 mt -97.93 114.92 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 125.015 1.326 . . . . 0.0 107.845 172.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.26 87.45 7.14 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.46 0.704 . . . . 0.0 110.203 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.2 m -144.94 165.63 27.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.739 2.015 . . . . 0.0 112.549 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -74.22 164.28 62.35 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 124.339 1.056 . . . . 0.0 110.761 161.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.28 -23.98 17.2 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.509 2.139 . . . . 0.0 114.147 174.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.21 -55.59 44.73 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 124.419 1.088 . . . . 0.0 113.466 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.46 -1.51 9.18 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 123.107 2.538 . . . . 0.0 114.575 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.55 -54.24 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 126.249 1.819 . . . . 0.0 109.398 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -45.33 81.22 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.25 -0.906 . . . . 0.0 112.912 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.85 -3.63 36.28 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -171.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 52.8 mt -53.93 -35.34 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 123.609 0.764 . . . . 0.0 110.665 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 21.0 p -111.39 158.43 19.08 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.245 1.418 . . . . 0.0 113.118 173.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -155.56 112.99 3.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.978 1.711 . . . . 0.0 110.402 175.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.09 2.95 90.57 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.666 1.127 . . . . 0.0 114.97 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 50.6 mt -77.33 118.53 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.967 1.307 . . . . 0.0 111.063 -176.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.0 mt -111.15 -13.1 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.595 1.958 . . . . 0.0 111.046 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.2 1.96 6.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.389 2.276 . . . . 0.0 116.355 -168.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.66 68.47 0.82 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.594 1.558 . . . . 0.0 112.431 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -158.06 149.36 21.22 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.361 1.864 . . . . 0.0 110.516 -176.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -140.4 -168.1 2.48 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.643 -1.286 . . . . 0.0 111.364 164.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -126.36 149.38 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 125.636 1.575 . . . . 0.0 109.729 168.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.4 tp -53.47 142.39 22.28 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.75 1.22 . . . . 0.0 111.644 168.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.52 173.24 1.7 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 173.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.6 t -124.9 -23.38 4.29 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.755 1.222 . . . . 0.0 114.177 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.9 m -79.59 170.52 16.43 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.38 1.072 . . . . 0.0 111.498 169.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -124.73 104.94 8.93 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.139 0.976 . . . . 0.0 111.522 -173.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -101.65 163.11 12.43 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.058 2.143 . . . . 0.0 110.798 -171.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -75.6 105.89 6.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.597 -0.689 . . . . 0.0 110.669 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.81 119.47 35.34 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.834 1.253 . . . . 0.0 111.667 178.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.8 t -119.64 87.63 2.78 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 126.041 1.736 . . . . 0.0 110.001 -171.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.9 163.94 21.9 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.325 1.06 . . . . 0.0 111.318 168.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -154.99 124.45 6.41 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.67 1.588 . . . . 0.0 108.689 162.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -111.04 139.39 46.44 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.357 1.063 . . . . 0.0 109.909 -175.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 16.0 t -60.99 148.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.754 0.822 . . . . 0.0 111.89 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.2 t -140.48 86.05 2.04 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-O 122.694 1.235 . . . . 0.0 111.867 173.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.255 1.389 0 C-N-CA 125.745 1.618 . . . . 0.0 111.993 174.664 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo . . . . . 0 CA--C 1.538 0.691 0 N-CA-C 113.165 0.409 . . . . 0.0 113.165 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -141.11 167.49 22.06 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.701 2.4 . . . . 0.0 109.204 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.511 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.3 mmpt? -93.43 143.86 25.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.533 0.733 . . . . 0.0 111.174 172.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -138.25 161.64 36.36 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.557 1.543 . . . . 0.0 111.473 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -97.43 154.23 17.61 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 127.297 2.239 . . . . 0.0 110.863 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.2 tp -79.83 128.47 33.48 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.964 0.906 . . . . 0.0 111.062 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.9 tptt -148.66 97.08 2.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.519 1.528 . . . . 0.0 111.771 173.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -110.72 142.52 42.53 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.819 1.247 . . . . 0.0 110.931 175.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 38.7 m -153.42 172.69 16.71 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.971 1.708 . . . . 0.0 111.066 -176.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 m -145.44 101.57 3.6 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.969 -1.082 . . . . 0.0 110.885 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.28 175.12 8.51 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.034 1.333 . . . . 0.0 113.316 -176.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.12 170.7 3.44 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 128.215 2.606 . . . . 0.0 113.801 171.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -140.06 142.56 36.15 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.116 1.767 . . . . 0.0 111.802 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -101.62 141.82 33.91 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.855 0.862 . . . . 0.0 111.405 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.2 m -146.75 -178.95 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 126.32 1.848 . . . . 0.0 111.282 -175.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.2 m -125.68 117.92 24.53 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.436 1.094 . . . . 0.0 111.194 174.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -84.4 134.57 34.47 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.564 0.697 . . . . 0.0 111.336 172.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.75 114.62 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.421 1.489 . . . . 0.0 108.403 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 57.98 55.78 5.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.668 1.187 . . . . 0.0 112.504 -171.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.9 24.43 11.23 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 127.655 2.382 . . . . 0.0 115.189 169.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.16 133.41 6.14 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 124.914 1.285 . . . . 0.0 109.421 -176.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.04 103.39 1.73 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.71 2.94 . . . . 0.0 112.354 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 m -98.41 10.08 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.178 1.391 . . . . 0.0 112.288 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -150.62 143.66 24.75 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.851 1.659 . . . . 0.0 112.295 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -98.2 137.12 37.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.217 1.007 . . . . 0.0 111.29 174.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -110.86 -53.77 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.97 0.908 . . . . 0.0 111.754 178.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.38 -171.12 42.91 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-N 118.782 0.719 . . . . 0.0 114.227 -174.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.14 129.45 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 0.0 109.799 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.16 0.21 7.19 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -168.58 164.27 12.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.577 2.351 . . . . 0.0 110.645 -174.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.5 m . . . . . 0 CA--C 1.543 0.692 0 C-N-CA 125.994 1.718 . . . . 0.0 111.419 173.968 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 p30 . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 123.107 1.432 . . . . 0.0 112.94 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -59.44 -34.05 72.03 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.436 1.895 . . . . 0.0 113.715 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.09 -44.73 96.04 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.982 -1.073 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 p -76.18 -28.02 57.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.05 1.34 . . . . 0.0 113.965 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -52.44 -45.19 65.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.65 1.568 . . . . 0.0 112.749 176.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.58 -62.81 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.447 1.099 . . . . 0.0 110.629 173.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -60.55 -19.78 58.37 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.67 -51.15 44.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.176 1.79 . . . . 0.0 113.769 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -151.24 23.4 0.73 Allowed 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -174.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -127.99 148.9 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 125.493 1.517 . . . . 0.0 109.367 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -146.74 156.95 43.55 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -92.74 2.7 56.6 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.227 1.811 . . . . 0.0 112.403 169.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.03 114.06 2.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.216 1.806 . . . . 0.0 111.089 172.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.6 ttp-105 -66.58 106.33 1.76 Allowed 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.675 -1.266 . . . . 0.0 110.643 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -116.05 4.16 13.68 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.353 1.461 . . . . 0.0 113.346 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.3 p -75.91 145.69 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.392 1.077 . . . . 0.0 112.978 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -130.88 6.85 4.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.24 1.816 . . . . 0.0 112.943 173.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 m 50.78 47.7 24.08 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 127.589 2.355 . . . . 0.0 113.53 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.12 -28.23 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.651 2.38 . . . . 0.0 112.323 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -103.65 0.44 30.7 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.183 1.393 . . . . 0.0 113.563 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.7 pt -62.81 -11.53 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.095 1.358 . . . . 0.0 113.706 177.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -54.67 -31.3 57.5 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.238 1.015 . . . . 0.0 112.899 165.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.1 m -82.39 1.71 35.95 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.219 1.408 . . . . 0.0 114.527 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.7 p -118.0 -176.12 2.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.895 1.678 . . . . 0.0 111.715 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -64.86 -19.12 65.72 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.21 13.08 12.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.364 1.866 . . . . 0.0 114.208 -172.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -66.31 -9.74 35.95 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.032 2.133 . . . . 0.0 114.82 -172.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -7.75 3.78 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.625 2.37 . . . . 0.0 115.554 -173.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.0 t 39.11 58.69 1.8 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 126.793 2.037 . . . . 0.0 113.635 -168.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.91 160.98 29.72 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.136 1.374 . . . . 0.0 112.025 162.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.84 -31.27 71.77 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -170.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -160.12 156.23 26.42 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.402 1.481 . . . . 0.0 111.959 169.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -132.1 112.68 12.53 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.115 0.966 . . . . 0.0 111.032 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.8 m -83.43 96.71 8.64 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.442 0.697 . . . . 0.0 110.439 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -80.64 132.87 35.65 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 122.835 0.454 . . . . 0.0 111.233 173.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 78.1 mt -104.95 113.54 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.196 1.398 . . . . 0.0 107.661 171.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -85.6 86.43 7.37 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.313 0.578 . . . . 0.0 109.614 167.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -150.39 167.42 27.14 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.95 1.3 . . . . 0.0 112.518 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -79.85 160.68 68.53 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 126.059 1.744 . . . . 0.0 110.536 175.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -70.54 -22.84 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.076 1.851 . . . . 0.0 114.593 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.32 -57.14 21.7 Favored Pre-proline 0 N--CA 1.473 0.721 0 C-N-CA 124.214 1.006 . . . . 0.0 112.977 -178.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.04 -0.27 5.34 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.212 2.608 . . . . 0.0 114.897 178.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.6 t -101.33 -54.9 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.584 1.953 . . . . 0.0 109.736 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -45.78 78.55 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.288 -0.883 . . . . 0.0 112.924 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.53 -2.96 31.46 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.4 mt -53.41 -35.87 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.618 0.767 . . . . 0.0 110.486 169.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.1 p -109.56 158.93 17.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.415 1.086 . . . . 0.0 113.222 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -155.57 103.27 2.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.114 1.766 . . . . 0.0 109.899 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.93 4.57 84.51 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.389 0.995 . . . . 0.0 114.807 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.2 mt -74.93 114.76 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.599 1.2 . . . . 0.0 111.113 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.93 -15.13 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 126.717 2.007 . . . . 0.0 110.68 171.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.54 23.92 0.21 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.666 2.787 . . . . 0.0 115.45 -171.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.2 p 41.28 64.63 0.97 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.334 1.854 . . . . 0.0 114.069 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.6 158.7 40.13 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.709 1.603 . . . . 0.0 111.215 -177.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -142.34 -170.63 3.22 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.738 -1.226 . . . . 0.0 111.796 160.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -124.09 139.58 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.541 1.537 . . . . 0.0 108.705 171.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.85 140.17 12.22 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.551 1.14 . . . . 0.0 111.906 170.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.4 172.28 1.59 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.1 t -119.55 -29.65 5.04 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.969 1.308 . . . . 0.0 113.366 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.7 m -77.14 169.58 18.08 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.305 1.442 . . . . 0.0 112.171 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -117.83 107.39 14.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.442 1.097 . . . . 0.0 111.22 -177.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -100.55 161.81 13.35 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.729 1.612 . . . . 0.0 110.595 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -72.1 106.38 4.32 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.285 0.564 . . . . 0.0 110.294 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -97.63 122.19 40.42 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.498 1.519 . . . . 0.0 110.889 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 37.8 t -126.14 93.63 3.87 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.512 1.525 . . . . 0.0 109.312 -173.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -93.69 163.09 13.68 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.286 1.041 . . . . 0.0 111.057 172.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -148.51 134.8 19.44 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.54 1.536 . . . . 0.0 108.429 164.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.3 m-80 -118.27 127.94 54.2 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.512 1.125 . . . . 0.0 110.391 -175.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.27 144.85 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.657 0.783 . . . . 0.0 111.874 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -135.31 103.51 5.53 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.919 1.287 . . . . 0.0 111.197 173.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.255 1.351 0 C-N-CA 126.238 1.815 . . . . 0.0 112.394 179.662 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo . . . . . 0 CA--C 1.537 0.643 0 CA-C-O 120.694 0.206 . . . . 0.0 112.239 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.79 168.82 18.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.466 1.906 . . . . 0.0 110.207 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -88.79 127.96 35.63 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.653 1.181 . . . . 0.0 111.161 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -138.79 155.32 48.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.422 1.089 . . . . 0.0 113.336 179.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -93.77 155.41 17.24 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.254 2.222 . . . . 0.0 111.725 179.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.39 114.5 21.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.678 1.591 . . . . 0.0 111.675 176.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -139.34 114.87 9.89 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.582 1.553 . . . . 0.0 111.338 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -132.74 147.39 52.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.742 1.617 . . . . 0.0 111.179 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.8 m -156.86 171.86 19.67 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.535 1.934 . . . . 0.0 111.683 -177.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -142.38 105.02 4.51 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.548 -0.72 . . . . 0.0 111.103 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.68 173.98 5.16 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.051 1.34 . . . . 0.0 113.397 -170.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.9 173.43 0.77 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.596 2.358 . . . . 0.0 114.273 168.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.9 p90 -144.14 145.34 32.05 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.022 2.129 . . . . 0.0 111.441 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 t -107.17 143.94 34.62 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.915 0.864 . . . . 0.0 112.441 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.0 m -149.22 -179.39 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 126.621 1.968 . . . . 0.0 111.62 -171.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 m -126.36 120.53 30.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.148 0.979 . . . . 0.0 111.336 174.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.31 132.69 34.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.961 0.905 . . . . 0.0 111.277 174.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -136.85 121.72 18.76 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.229 1.412 . . . . 0.0 108.53 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 55.43 53.76 9.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.614 1.165 . . . . 0.0 112.46 -171.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 64.91 26.45 12.82 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.379 2.271 . . . . 0.0 115.04 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -156.54 132.78 6.0 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.806 1.243 . . . . 0.0 109.587 -176.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -76.06 105.37 2.07 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.735 2.957 . . . . 0.0 112.283 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.3 m -104.61 15.83 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.688 1.595 . . . . 0.0 112.397 -179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -154.96 145.74 22.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.696 1.135 . . . . 0.0 112.114 -176.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -102.15 137.53 40.29 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.534 1.134 . . . . 0.0 111.356 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 43.9 t -111.87 -52.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.926 0.89 . . . . 0.0 112.539 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.23 -172.43 43.45 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-N 119.194 0.906 . . . . 0.0 115.198 -171.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t -128.19 126.82 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.976 1.71 . . . . 0.0 110.786 -170.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.51 -13.12 5.2 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.746 1.165 . . . . 0.0 115.753 176.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.6 m -163.35 169.61 18.78 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 130.926 3.691 . . . . 0.0 108.469 -164.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 CA--C 1.54 0.569 0 C-N-CA 124.045 0.938 . . . . 0.0 111.383 179.221 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 122.677 1.227 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.4 ' NE1' ' HE3' ' A' ' 93' ' ' LYS . 2.7 t-105 -56.65 -37.08 70.27 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.477 2.311 . . . . 0.0 112.698 170.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -42.63 91.24 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 0.0 111.357 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.3 p -85.4 -27.14 25.99 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.119 1.368 . . . . 0.0 113.941 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -51.48 -41.68 61.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.283 1.433 . . . . 0.0 112.682 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -57.56 -64.34 0.93 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.026 0.931 . . . . 0.0 110.614 172.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -59.87 -21.0 60.41 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -65.77 -51.44 59.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.307 1.843 . . . . 0.0 112.572 175.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -150.46 22.21 0.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -174.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -128.91 144.67 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.196 -1.565 . . . . 0.0 109.517 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -143.06 153.46 42.96 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -84.38 -0.45 52.72 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.733 1.613 . . . . 0.0 112.714 169.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.7 t -164.09 112.18 1.15 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.259 1.824 . . . . 0.0 111.405 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.6 ttp85 -67.99 104.53 1.76 Allowed 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.429 -1.42 . . . . 0.0 110.583 172.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -116.84 3.31 12.91 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.457 1.503 . . . . 0.0 113.193 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.5 p -73.8 147.4 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.042 1.337 . . . . 0.0 112.573 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -134.6 9.18 3.64 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.92 1.688 . . . . 0.0 112.531 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.2 m 51.47 38.68 22.7 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.444 2.298 . . . . 0.0 113.193 -175.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -145.33 -36.17 0.3 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 128.386 2.674 . . . . 0.0 112.655 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -100.08 -4.33 30.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.666 1.586 . . . . 0.0 113.633 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -60.27 -14.59 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.546 1.138 . . . . 0.0 113.637 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.8 ttt -53.91 -26.63 26.1 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.938 1.695 . . . . 0.0 113.568 168.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.0 t -103.49 1.98 33.05 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.95 1.7 . . . . 0.0 113.849 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -103.31 -174.2 2.49 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 125.494 1.518 . . . . 0.0 111.552 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -63.25 -20.62 65.61 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.129 -0.982 . . . . 0.0 113.582 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.38 12.32 27.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.77 1.628 . . . . 0.0 114.059 -166.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -65.2 -5.11 6.09 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.516 2.726 . . . . 0.0 114.914 -176.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.5 t60 -61.27 -4.8 1.31 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.976 2.11 . . . . 0.0 115.069 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.4 t 56.55 33.76 23.21 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.327 1.851 . . . . 0.0 113.77 -177.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 160.08 14.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.377 1.471 . . . . 0.0 112.351 176.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -67.04 -36.45 82.1 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.562 1.145 . . . . 0.0 113.754 -172.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -159.66 159.62 33.24 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.049 1.34 . . . . 0.0 111.841 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -140.52 127.98 21.35 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.383 0.673 . . . . 0.0 110.433 167.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.0 m -92.41 91.95 7.88 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.685 176.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -75.63 125.29 28.74 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.657 0.783 . . . . 0.0 111.043 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 91.5 mt -103.41 115.8 46.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 125.39 1.476 . . . . 0.0 107.661 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -89.49 86.17 6.7 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.67 0.748 . . . . 0.0 109.749 169.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.0 p -146.46 166.59 25.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.092 1.757 . . . . 0.0 111.959 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 29.1 mmm-85 -78.71 161.09 70.52 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 125.092 1.357 . . . . 0.0 110.422 172.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.93 -21.23 32.99 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 122.102 1.868 . . . . 0.0 114.436 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.12 -57.0 23.05 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-O 117.983 -1.008 . . . . 0.0 112.575 -178.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.22 -0.25 5.44 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.25 2.633 . . . . 0.0 115.168 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -100.96 -55.24 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 126.07 1.748 . . . . 0.0 109.833 174.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.4 ' HE3' ' NE1' ' A' ' 51' ' ' TRP . 0.0 OUTLIER -67.09 -44.4 80.11 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.159 -0.963 . . . . 0.0 112.989 -179.204 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.47 -2.96 31.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -173.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.36 -35.77 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.668 0.787 . . . . 0.0 110.483 169.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.3 p -109.67 158.54 17.97 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.414 1.086 . . . . 0.0 113.308 174.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -153.26 107.72 3.12 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.318 1.847 . . . . 0.0 109.833 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.6 5.23 90.06 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.337 0.97 . . . . 0.0 114.786 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.4 mt -75.73 114.74 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.564 1.146 . . . . 0.0 111.028 -177.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.1 mt -109.58 -12.62 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 126.685 1.994 . . . . 0.0 110.861 172.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.99 5.45 3.31 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.665 2.386 . . . . 0.0 116.143 -171.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.4 t 51.39 65.73 1.4 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.58 1.552 . . . . 0.0 112.904 -172.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -154.44 157.93 39.2 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.214 1.806 . . . . 0.0 111.076 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -142.02 -169.98 3.05 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.783 -1.198 . . . . 0.0 111.86 163.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.5 t -124.36 141.87 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.681 1.592 . . . . 0.0 108.7 170.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -51.02 142.31 12.32 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.811 1.245 . . . . 0.0 111.742 169.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.54 172.24 2.17 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.0 t -120.26 -26.28 5.5 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.199 1.399 . . . . 0.0 113.519 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.0 m -81.06 171.01 15.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.492 1.517 . . . . 0.0 112.006 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -116.54 110.56 18.73 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.504 1.122 . . . . 0.0 111.34 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -106.38 158.31 16.98 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.818 1.647 . . . . 0.0 109.893 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.45 110.75 5.53 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.634 -0.666 . . . . 0.0 110.719 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -101.03 125.51 47.65 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.635 1.574 . . . . 0.0 111.766 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 39.0 t -130.8 91.7 3.11 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.386 1.475 . . . . 0.0 110.796 -172.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -85.5 163.32 18.5 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.959 0.885 . . . . 0.0 111.87 170.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -146.05 140.59 26.9 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 158.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -128.82 129.35 45.49 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.983 0.913 . . . . 0.0 109.907 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.83 146.63 8.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.87 0.868 . . . . 0.0 112.687 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.02 77.77 1.68 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 122.926 1.346 . . . . 0.0 111.863 174.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 75.7 m . . . . . 0 C--O 1.252 1.221 0 C-N-CA 127.44 2.296 . . . . 0.0 112.697 177.708 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo . . . . . 0 CA--C 1.545 1.064 0 N-CA-C 113.642 0.593 . . . . 0.0 113.642 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 86.9 m -128.53 174.84 9.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 127.224 2.21 . . . . 0.0 109.482 169.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -105.48 145.19 31.21 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.173 1.389 . . . . 0.0 108.625 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.78 158.51 43.85 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.942 1.297 . . . . 0.0 110.923 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -100.11 159.42 15.12 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 113.22 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.57 105.7 17.03 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.654 1.582 . . . . 0.0 111.362 -169.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -131.96 112.47 12.43 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.638 1.575 . . . . 0.0 111.051 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -131.44 141.91 49.91 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.916 1.687 . . . . 0.0 111.016 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.4 m -146.74 168.06 22.31 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.807 1.643 . . . . 0.0 111.348 -175.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -141.15 103.65 4.48 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.572 -0.705 . . . . 0.0 111.296 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.0 173.52 5.06 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.99 1.316 . . . . 0.0 113.068 -169.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.25 171.77 0.96 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.489 2.316 . . . . 0.0 113.841 167.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -142.64 147.7 36.21 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.783 2.033 . . . . 0.0 111.197 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.3 t -107.58 141.34 39.19 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.896 0.879 . . . . 0.0 111.341 176.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -146.86 -178.92 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 126.35 1.86 . . . . 0.0 111.25 -175.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 m -126.77 119.24 26.39 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 121.257 -0.902 . . . . 0.0 111.45 176.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.2 132.4 34.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.96 0.904 . . . . 0.0 111.668 175.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -140.13 115.67 10.06 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.038 1.335 . . . . 0.0 108.796 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 58.68 56.37 4.24 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.273 1.429 . . . . 0.0 112.397 -169.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 64.54 24.3 13.04 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.737 2.415 . . . . 0.0 115.06 169.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.86 132.71 5.43 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.827 1.251 . . . . 0.0 109.444 -173.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -76.28 106.45 2.26 Favored 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 123.794 2.996 . . . . 0.0 112.189 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 5.9 m -101.38 14.33 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.329 1.452 . . . . 0.0 111.85 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -158.95 141.8 14.39 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.037 1.29 . . . . 0.0 112.651 -167.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -92.67 146.95 23.27 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.613 0.765 . . . . 0.0 112.096 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.9 t -120.1 -55.7 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 124.146 0.978 . . . . 0.0 112.436 172.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.39 -173.36 42.83 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 119.297 0.953 . . . . 0.0 115.388 -170.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -127.0 122.99 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.97 1.708 . . . . 0.0 110.235 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.54 -0.05 7.44 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 115.959 1.143 . . . . 0.0 115.959 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.1 m -170.29 165.66 8.86 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 129.28 3.032 . . . . 0.0 110.289 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.9 m . . . . . 0 CA--C 1.542 0.673 0 C-N-CA 125.742 1.617 . . . . 0.0 110.839 174.731 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 t0 . . . . . 0 CA--C 1.543 0.695 0 CA-C-O 122.528 1.156 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.41 ' NE1' ' HE3' ' A' ' 93' ' ' LYS . 2.5 t-105 -53.74 -36.56 62.44 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 127.079 2.152 . . . . 0.0 112.274 168.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.32 -45.44 93.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.809 0.844 . . . . 0.0 111.015 177.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.9 p -72.01 -35.61 69.47 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -54.14 -44.11 71.13 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.463 1.505 . . . . 0.0 113.065 -177.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.14 -62.04 1.91 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.367 1.067 . . . . 0.0 110.725 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -20.29 63.24 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -68.62 -54.78 14.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 113.437 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -133.17 6.7 3.9 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -172.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.12 147.49 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 O-C-N 120.387 -1.446 . . . . 0.0 110.107 -173.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -142.49 153.26 43.49 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -81.55 -5.54 58.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.857 1.663 . . . . 0.0 112.882 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.1 t -165.14 121.22 1.41 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.633 1.973 . . . . 0.0 110.569 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.0 ttp-105 -66.44 104.52 1.26 Allowed 'General case' 0 N--CA 1.473 0.711 0 O-C-N 120.488 -1.383 . . . . 0.0 110.8 174.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -113.97 2.79 15.13 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.219 1.408 . . . . 0.0 113.455 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.7 p -74.7 146.03 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.115 0.966 . . . . 0.0 112.235 178.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -130.4 7.36 4.93 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.891 1.676 . . . . 0.0 112.742 171.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.6 m 52.26 42.99 31.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.602 2.361 . . . . 0.0 113.023 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -155.77 -25.61 0.11 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.405 2.282 . . . . 0.0 113.349 -178.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -106.32 -4.21 20.29 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.058 1.343 . . . . 0.0 113.94 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 pt -60.33 -12.29 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.006 1.322 . . . . 0.0 113.885 -179.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -24.23 28.36 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 167.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 69.8 m -91.29 -5.37 54.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.363 1.465 . . . . 0.0 114.356 174.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.4 p -103.43 -176.7 3.16 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.497 1.519 . . . . 0.0 111.927 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -64.98 -19.49 66.01 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.173 -0.954 . . . . 0.0 113.465 171.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -93.64 20.12 7.82 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.008 2.123 . . . . 0.0 113.471 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -63.94 -9.26 14.52 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.022 2.129 . . . . 0.0 114.61 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -63.55 -2.33 1.59 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.853 2.461 . . . . 0.0 115.342 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 57.82 21.03 7.08 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.149 1.78 . . . . 0.0 114.755 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.67 157.81 11.21 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.79 2.036 . . . . 0.0 114.485 -173.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.02 -39.46 78.4 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.081 1.752 . . . . 0.0 114.694 -168.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -159.4 157.49 30.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.161 1.384 . . . . 0.0 112.525 167.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -135.1 128.67 32.63 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.339 1.056 . . . . 0.0 110.532 167.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.1 m -88.77 99.12 12.11 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.989 0.916 . . . . 0.0 109.659 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -82.5 135.05 35.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.321 -0.862 . . . . 0.0 112.337 174.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 66.4 mt -107.73 111.17 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 125.702 1.601 . . . . 0.0 107.676 174.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.98 86.67 7.35 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.56 -0.713 . . . . 0.0 109.845 169.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 t -152.32 175.0 13.13 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.244 1.018 . . . . 0.0 113.338 168.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -74.61 162.68 72.62 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 128.03 2.532 . . . . 0.0 110.678 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.43 -24.94 18.7 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 122.267 1.978 . . . . 0.0 114.02 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.82 -55.53 37.36 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.397 1.079 . . . . 0.0 113.07 -176.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.26 -1.26 7.75 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.829 2.353 . . . . 0.0 114.724 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.7 t -99.89 -54.61 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.152 1.781 . . . . 0.0 109.6 174.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.41 ' HE3' ' NE1' ' A' ' 51' ' ' TRP . 0.0 OUTLIER -66.54 -46.06 77.39 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.217 -0.927 . . . . 0.0 112.983 -179.184 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.56 -2.99 31.69 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -171.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.0 mt -53.25 -35.89 24.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.793 0.837 . . . . 0.0 110.599 169.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -110.34 158.97 17.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 0.0 113.204 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -156.41 104.34 2.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.18 1.792 . . . . 0.0 109.932 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.92 3.15 85.81 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 124.465 1.031 . . . . 0.0 114.949 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.0 mt -74.82 115.48 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.542 1.171 . . . . 0.0 111.238 -177.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -108.81 -13.1 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 126.383 1.873 . . . . 0.0 110.962 171.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.06 4.1 3.82 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.517 2.327 . . . . 0.0 116.262 -170.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.4 t 53.14 64.4 1.87 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.619 1.568 . . . . 0.0 112.804 -173.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -155.49 158.23 38.19 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.399 1.88 . . . . 0.0 111.091 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -141.52 -167.97 2.54 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.659 -1.275 . . . . 0.0 111.721 164.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.59 146.18 31.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 125.579 1.552 . . . . 0.0 109.603 167.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.6 tp -51.41 142.72 13.06 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.891 1.276 . . . . 0.0 112.002 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.73 173.09 1.86 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -122.99 -23.89 4.88 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.092 1.357 . . . . 0.0 113.943 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.8 m -81.42 171.07 15.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.778 1.231 . . . . 0.0 111.947 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.76 106.65 13.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.778 1.231 . . . . 0.0 111.676 -176.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -101.28 162.73 12.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.036 1.735 . . . . 0.0 110.877 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -73.3 105.64 4.79 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.694 -0.629 . . . . 0.0 110.382 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.96 122.63 38.98 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.068 1.347 . . . . 0.0 111.466 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 32.8 t -124.72 91.42 3.44 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.997 1.319 . . . . 0.0 110.726 -173.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -83.98 161.8 20.64 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.601 0.76 . . . . 0.0 111.693 171.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.76 109.78 3.7 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.115 0.966 . . . . 0.0 110.669 163.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.53 130.91 43.6 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.515 1.126 . . . . 0.0 110.828 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.4 t -57.74 150.38 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.321 1.448 . . . . 0.0 112.137 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 68.1 p -123.97 101.19 7.11 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.622 1.569 . . . . 0.0 111.453 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 55.2 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 128.078 2.551 . . . . 0.0 114.512 178.719 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 CA--C 1.538 0.701 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.28 176.82 9.26 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.59 2.356 . . . . 0.0 109.6 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 11.4 mmpt? -115.28 131.98 56.76 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.982 1.313 . . . . 0.0 110.702 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -136.2 160.67 37.99 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.531 . . . . 0.0 112.151 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -92.2 155.83 17.73 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.631 1.972 . . . . 0.0 112.145 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 107.71 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.652 1.581 . . . . 0.0 111.395 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.1 tptt -136.56 114.73 11.57 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.686 1.595 . . . . 0.0 111.069 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -133.34 132.09 40.88 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.989 1.716 . . . . 0.0 110.609 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 66.1 m -144.87 178.48 7.98 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.523 1.929 . . . . 0.0 111.595 -172.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 m -147.01 102.11 3.48 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.588 -1.32 . . . . 0.0 110.871 178.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -163.35 173.7 12.91 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.47 1.108 . . . . 0.0 113.652 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 168.31 5.19 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 128.133 2.573 . . . . 0.0 113.433 172.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.3 p90 -139.77 140.37 36.68 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.707 1.603 . . . . 0.0 111.868 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.6 t -98.72 143.11 29.44 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.204 1.002 . . . . 0.0 111.487 174.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.5 m -147.22 -178.6 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 126.565 1.946 . . . . 0.0 111.193 -176.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.2 m -127.35 119.53 26.45 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.333 -0.854 . . . . 0.0 111.307 174.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.67 133.59 33.68 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.552 0.741 . . . . 0.0 111.248 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -138.73 114.33 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.337 1.455 . . . . 0.0 108.472 175.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 58.27 56.44 4.48 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.0 1.32 . . . . 0.0 112.489 -170.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.01 25.02 12.65 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.492 2.317 . . . . 0.0 115.091 169.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.39 132.57 5.55 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.921 1.288 . . . . 0.0 109.553 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -76.26 105.52 2.09 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.812 3.008 . . . . 0.0 112.147 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.5 m -101.02 15.14 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.106 1.363 . . . . 0.0 111.956 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.7 t-80 -157.47 139.82 14.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.877 1.217 . . . . 0.0 112.741 -169.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -96.75 140.58 31.12 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.721 0.808 . . . . 0.0 111.306 173.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 92.1 t -109.8 -58.06 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.073 0.949 . . . . 0.0 111.598 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.08 -173.45 45.6 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 118.648 0.658 . . . . 0.0 113.191 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.4 p -115.46 138.76 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.295 1.038 . . . . 0.0 110.981 178.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 60.46 4.69 4.1 Favored Glycine 0 CA--C 1.544 1.895 0 N-CA-C 116.992 1.557 . . . . 0.0 116.992 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -167.41 158.93 11.99 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.213 2.205 . . . . 0.0 110.749 -174.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.2 m . . . . . 0 CA--C 1.54 0.566 0 C-N-CA 126.004 1.721 . . . . 0.0 111.042 172.983 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t0 . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 121.884 0.85 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -55.31 -37.74 67.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.51 1.924 . . . . 0.0 112.139 170.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -37.6 78.17 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.775 1.23 . . . . 0.0 112.187 -179.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -92.81 -25.2 18.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.778 1.231 . . . . 0.0 113.587 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -52.65 -41.62 63.94 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.531 1.532 . . . . 0.0 113.15 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -56.83 -61.54 2.36 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.081 0.953 . . . . 0.0 110.588 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -56.5 -26.35 54.15 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -65.73 -48.42 71.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.284 1.434 . . . . 0.0 112.863 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -153.16 24.51 0.55 Allowed 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.277 1.584 . . . . 0.0 115.277 -176.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -129.66 145.1 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.527 -1.358 . . . . 0.0 109.538 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.3 t -145.21 158.67 43.77 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -90.72 3.44 54.28 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.487 1.915 . . . . 0.0 112.679 167.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.1 t -164.44 113.84 1.17 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.506 1.922 . . . . 0.0 111.3 174.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -66.57 104.25 1.24 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.606 -1.309 . . . . 0.0 110.628 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -115.58 4.3 14.14 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.537 1.535 . . . . 0.0 113.374 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.0 p -72.68 145.21 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.891 1.276 . . . . 0.0 112.721 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -132.47 5.66 4.06 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.17 1.788 . . . . 0.0 113.106 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 34.6 m 52.64 39.72 28.8 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.521 2.328 . . . . 0.0 114.378 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -153.87 -27.35 0.13 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 128.34 2.656 . . . . 0.0 112.213 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -109.1 2.36 21.08 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.709 1.603 . . . . 0.0 113.695 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -61.58 -12.66 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.171 1.388 . . . . 0.0 113.6 177.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -52.44 -34.15 47.46 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.641 1.176 . . . . 0.0 112.879 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.3 t -80.7 2.3 26.53 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.119 1.368 . . . . 0.0 114.218 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.1 p -121.19 -177.45 3.52 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.967 1.707 . . . . 0.0 111.845 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -62.51 -19.66 63.83 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 172.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.73 7.31 24.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.315 1.846 . . . . 0.0 114.558 -171.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -64.07 -5.57 4.94 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.968 2.107 . . . . 0.0 114.904 -176.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -61.92 -5.45 2.12 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.435 1.894 . . . . 0.0 114.681 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.6 t 53.0 35.61 19.88 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.301 2.241 . . . . 0.0 114.847 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 160.57 17.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.868 1.667 . . . . 0.0 113.063 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -68.34 -27.32 66.16 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.059 1.744 . . . . 0.0 115.253 -171.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -162.72 159.04 23.8 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.425 1.49 . . . . 0.0 112.404 166.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -134.19 141.78 47.18 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.3 1.04 . . . . 0.0 110.557 168.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.2 m -108.2 94.12 4.9 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.978 1.311 . . . . 0.0 109.532 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -78.98 136.09 37.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.78 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 88.8 mt -113.26 115.65 50.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 126.077 1.751 . . . . 0.0 108.271 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -85.15 86.41 7.38 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.775 -0.578 . . . . 0.0 110.327 168.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.4 m -142.09 155.04 45.35 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.193 1.397 . . . . 0.0 112.748 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.1 mtp180 -70.36 161.78 74.16 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.239 1.016 . . . . 0.0 110.174 162.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.79 -22.33 37.02 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.764 1.643 . . . . 0.0 114.632 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.26 -58.19 20.6 Favored Pre-proline 0 N--CA 1.474 0.763 0 CA-C-N 119.691 1.132 . . . . 0.0 113.185 -177.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.21 0.5 5.14 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.339 2.692 . . . . 0.0 114.858 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.9 t -102.97 -55.07 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 126.515 1.926 . . . . 0.0 109.712 176.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.0 -44.86 79.27 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.27 -0.894 . . . . 0.0 112.819 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.7 -3.08 32.73 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -173.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.9 mt -53.45 -35.81 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 123.52 0.728 . . . . 0.0 110.473 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.2 p -109.29 158.94 17.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.461 1.104 . . . . 0.0 113.236 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -155.43 106.04 2.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.169 1.788 . . . . 0.0 109.961 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 4.09 87.57 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.483 1.04 . . . . 0.0 114.886 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.1 mt -75.73 115.15 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 118.5 1.15 . . . . 0.0 111.27 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.7 -11.89 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.628 1.971 . . . . 0.0 110.847 172.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 9.01 1.53 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.859 2.463 . . . . 0.0 116.1 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 83.0 p 49.27 63.76 2.02 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.757 1.623 . . . . 0.0 113.455 -172.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -154.61 155.71 35.2 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 126.715 2.006 . . . . 0.0 111.116 -176.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -141.9 -167.23 2.4 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.722 -1.236 . . . . 0.0 111.475 162.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 19.2 t -127.41 143.59 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.762 1.625 . . . . 0.0 108.711 170.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -50.05 141.25 11.2 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.567 1.147 . . . . 0.0 111.968 168.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 173.2 1.28 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 172.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -119.88 -32.74 4.16 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.75 1.22 . . . . 0.0 113.406 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.8 m -74.84 172.11 12.79 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.506 1.522 . . . . 0.0 112.168 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -121.21 116.63 25.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.583 1.153 . . . . 0.0 110.923 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -113.54 157.25 22.28 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.913 1.685 . . . . 0.0 109.805 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.63 112.45 4.17 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.398 0.545 . . . . 0.0 110.106 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.96 123.07 48.83 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.372 1.469 . . . . 0.0 110.843 -170.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 28.3 t -129.46 97.42 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.63 1.172 . . . . 0.0 109.924 -167.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -87.73 159.75 18.36 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.742 0.817 . . . . 0.0 110.779 171.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -145.08 128.09 16.52 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.963 0.905 . . . . 0.0 108.769 158.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -116.39 127.66 54.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.014 1.326 . . . . 0.0 109.849 -175.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 36.7 t -59.14 145.22 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-O 121.263 0.554 . . . . 0.0 112.111 -176.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.7 t -132.93 103.15 5.92 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.225 1.81 . . . . 0.0 110.955 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 99.2 p . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.601 1.56 . . . . 0.0 114.702 -179.481 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo . . . . . 0 CA--C 1.536 0.625 0 N-CA-C 112.039 -0.024 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 m -140.08 171.27 14.41 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.959 1.703 . . . . 0.0 110.477 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -92.35 130.65 37.98 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.114 1.366 . . . . 0.0 110.252 -178.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -137.54 161.04 37.46 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.412 1.085 . . . . 0.0 112.85 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -95.41 160.01 14.73 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.491 2.317 . . . . 0.0 111.665 178.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.47 106.16 18.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.957 1.703 . . . . 0.0 110.933 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -134.48 118.42 17.32 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.994 1.718 . . . . 0.0 111.377 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -125.64 152.92 44.55 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.117 1.367 . . . . 0.0 111.464 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 19.6 t -154.51 175.49 13.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.367 1.467 . . . . 0.0 111.42 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -144.88 101.65 3.67 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.956 -1.09 . . . . 0.0 110.441 173.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.72 178.64 7.72 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.082 1.353 . . . . 0.0 113.442 -178.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 170.78 9.16 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 128.053 2.541 . . . . 0.0 113.661 174.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -141.69 141.13 33.33 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.067 1.747 . . . . 0.0 112.065 -176.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.6 t -101.21 140.54 35.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.817 0.847 . . . . 0.0 111.793 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.5 m -146.58 -179.41 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 126.452 1.901 . . . . 0.0 111.251 -176.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.2 m -125.96 116.27 21.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.815 1.246 . . . . 0.0 111.04 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 m -85.29 132.32 34.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.594 0.634 . . . . 0.0 111.289 173.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -136.72 116.28 12.88 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 125.188 1.395 . . . . 0.0 108.323 174.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 57.87 55.98 5.04 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.86 1.264 . . . . 0.0 112.38 -170.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.33 25.18 12.13 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 127.439 2.295 . . . . 0.0 115.072 169.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.09 132.71 5.33 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.844 1.257 . . . . 0.0 109.787 -174.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.99 106.71 2.3 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 124.008 3.139 . . . . 0.0 113.5 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.3 m -108.65 14.95 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.888 2.075 . . . . 0.0 112.619 -178.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -151.66 143.91 24.02 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.612 -1.305 . . . . 0.0 111.672 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -100.63 132.68 45.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 111.425 176.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.1 t -107.85 -53.52 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.908 0.883 . . . . 0.0 111.982 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.64 -172.5 44.28 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-N 118.93 0.786 . . . . 0.0 114.504 -173.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -126.18 128.88 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.479 1.511 . . . . 0.0 109.722 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.58 2.92 8.3 Favored Glycine 0 CA--C 1.539 1.555 0 N-CA-C 116.354 1.302 . . . . 0.0 116.354 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -168.88 163.39 11.61 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 128.555 2.742 . . . . 0.0 110.232 -176.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.1 m . . . . . 0 CA--C 1.539 0.55 0 C-N-CA 125.733 1.613 . . . . 0.0 109.848 170.161 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 CA--C 1.541 0.614 0 CA-C-O 121.978 0.894 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.2 t-105 -55.37 -36.74 66.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.727 1.611 . . . . 0.0 111.406 167.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.81 -32.34 70.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.907 1.283 . . . . 0.0 112.465 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.1 p -97.94 -24.72 15.26 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.763 1.225 . . . . 0.0 113.737 175.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -52.85 -40.21 63.2 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.768 1.627 . . . . 0.0 112.992 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -58.08 -61.59 2.44 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.779 0.832 . . . . 0.0 111.196 172.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.93 -28.73 38.79 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 tmtm? -66.42 -44.84 81.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.676 1.59 . . . . 0.0 114.042 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -155.72 21.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.8 mt -127.59 146.52 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 120.145 -1.597 . . . . 0.0 109.412 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.45 154.64 43.15 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -88.89 2.1 54.3 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.949 1.7 . . . . 0.0 112.343 168.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.83 106.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.387 1.875 . . . . 0.0 111.409 174.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 ttp-105 -67.23 114.73 6.2 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.494 -1.379 . . . . 0.0 110.178 171.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -126.98 5.26 6.52 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.255 1.422 . . . . 0.0 113.293 176.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.9 p -71.37 150.3 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.24 1.416 . . . . 0.0 113.125 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -132.62 3.3 3.84 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.012 1.725 . . . . 0.0 112.877 173.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . 0.251 90.2 m 45.65 57.66 4.84 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.743 2.417 . . . . 0.0 112.083 -171.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -156.34 -43.69 0.07 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.585 2.354 . . . . 0.0 111.736 -163.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -113.47 0.02 14.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.714 2.005 . . . . 0.0 113.573 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.2 pt -60.65 -11.03 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.21 1.404 . . . . 0.0 113.966 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -25.76 29.21 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 167.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 t -89.4 -2.54 58.44 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.557 1.543 . . . . 0.0 113.794 176.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 p -108.82 -179.52 3.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.904 1.682 . . . . 0.0 111.51 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -69.45 -14.58 62.96 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 172.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -81.63 6.43 15.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.348 1.859 . . . . 0.0 114.743 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -65.23 -5.03 5.98 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 128.413 2.685 . . . . 0.0 115.237 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -62.56 -2.32 1.06 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.676 1.99 . . . . 0.0 115.25 -173.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 8.5 t 56.14 31.9 19.13 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.169 1.788 . . . . 0.0 113.263 -173.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.36 154.46 20.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.482 1.113 . . . . 0.0 112.03 176.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -63.64 -33.61 76.0 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.007 1.323 . . . . 0.0 113.692 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -164.43 160.21 20.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.097 1.759 . . . . 0.0 112.123 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t30 -138.26 123.62 19.42 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.227 1.011 . . . . 0.0 110.422 172.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 42.0 m -87.37 94.74 9.77 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.842 0.857 . . . . 0.0 109.428 173.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -78.75 132.85 37.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.002 -0.436 . . . . 0.0 111.1 172.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.1 mt -111.8 113.44 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.55 1.54 . . . . 0.0 107.966 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -85.82 84.39 7.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.89 -0.506 . . . . 0.0 110.522 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.0 m -141.2 159.03 43.07 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.998 1.319 . . . . 0.0 113.249 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -71.41 162.71 71.29 Favored Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 124.739 1.216 . . . . 0.0 111.363 162.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.22 -23.73 28.38 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.556 2.171 . . . . 0.0 114.355 176.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -60.86 -58.23 20.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-N 119.68 1.127 . . . . 0.0 112.884 -177.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.89 0.89 5.08 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.034 2.489 . . . . 0.0 114.93 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.54 -57.4 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 126.937 2.095 . . . . 0.0 110.156 177.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -40.03 79.67 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.335 -0.853 . . . . 0.0 112.708 -177.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.81 -3.5 44.82 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 62.2 mt -52.84 -36.36 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.777 0.717 . . . . 0.0 110.529 169.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.63 159.58 16.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.3 1.04 . . . . 0.0 113.081 174.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -156.0 104.99 2.32 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.535 1.534 . . . . 0.0 110.646 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.63 5.1 87.03 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.299 0.952 . . . . 0.0 114.99 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.7 mt -75.28 115.87 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.534 1.167 . . . . 0.0 111.155 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.2 mt -111.54 -11.92 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 126.629 1.972 . . . . 0.0 110.946 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 4.3 5.09 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.438 2.295 . . . . 0.0 116.007 -171.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 51.81 68.28 0.83 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.805 1.642 . . . . 0.0 113.041 -170.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -156.48 163.57 39.25 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.133 1.773 . . . . 0.0 111.018 176.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -143.52 -165.37 2.08 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.884 -1.135 . . . . 0.0 111.338 163.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.21 146.83 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 125.448 1.499 . . . . 0.0 109.285 165.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.0 tp -50.96 142.11 12.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.623 1.169 . . . . 0.0 111.409 167.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.19 174.32 0.94 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 171.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -117.19 -32.55 4.96 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.769 1.228 . . . . 0.0 113.529 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -78.76 176.01 9.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.519 1.927 . . . . 0.0 112.325 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -121.81 111.03 16.63 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.099 -1.001 . . . . 0.0 111.49 -177.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -107.95 160.33 15.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.203 1.801 . . . . 0.0 109.935 -174.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -70.91 110.78 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.687 -0.633 . . . . 0.0 110.845 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.16 126.87 50.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.813 1.645 . . . . 0.0 110.981 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.3 t -132.23 96.9 3.98 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.686 1.194 . . . . 0.0 109.961 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -103.6 135.66 44.76 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.157 1.383 . . . . 0.0 110.16 -178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 22.1 m -116.83 146.25 43.01 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.936 -1.102 . . . . 0.0 108.646 168.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -134.94 124.42 24.89 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.035 0.934 . . . . 0.0 109.344 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.3 t -58.01 147.37 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.015 0.926 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.7 t -136.45 86.11 2.2 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 122.782 1.277 . . . . 0.0 112.836 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 61.3 m . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.198 1.799 . . . . 0.0 112.784 173.739 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo . . . . . 0 CA--C 1.54 0.779 0 N-CA-C 112.784 0.263 . . . . 0.0 112.784 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 85.9 m -140.4 168.27 20.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.575 2.35 . . . . 0.0 109.599 176.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -93.45 140.44 29.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.324 1.05 . . . . 0.0 110.22 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -137.64 160.86 38.02 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.699 1.2 . . . . 0.0 112.46 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -94.46 153.74 17.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.741 2.016 . . . . 0.0 112.01 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.18 103.59 16.25 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.381 1.473 . . . . 0.0 111.22 -174.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -133.64 118.83 18.64 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.143 1.377 . . . . 0.0 111.456 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -129.51 152.22 49.29 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.04 1.736 . . . . 0.0 110.942 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.8 m -155.23 175.11 14.28 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.92 1.688 . . . . 0.0 111.43 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -144.71 104.77 4.06 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.936 -1.103 . . . . 0.0 110.838 175.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.77 172.17 6.91 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.916 1.286 . . . . 0.0 113.405 -171.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 172.86 1.09 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 128.329 2.652 . . . . 0.0 114.224 168.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -141.17 143.01 33.98 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.639 1.975 . . . . 0.0 111.7 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.4 t -103.49 138.85 39.63 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.069 0.947 . . . . 0.0 111.097 176.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.5 m -145.45 -179.49 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 125.905 1.682 . . . . 0.0 111.435 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.6 m -126.22 117.44 23.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.608 1.163 . . . . 0.0 111.527 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.87 130.08 34.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.832 0.853 . . . . 0.0 111.201 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -138.95 112.6 8.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.064 1.346 . . . . 0.0 108.925 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 58.82 58.51 3.21 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.154 1.382 . . . . 0.0 112.331 -172.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 62.84 27.64 16.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 127.27 2.228 . . . . 0.0 114.841 171.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.75 133.51 5.49 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.983 1.313 . . . . 0.0 109.767 -176.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 101.04 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 124.149 3.232 . . . . 0.0 112.308 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 m -96.21 1.26 10.38 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 C-N-CA 125.11 1.364 . . . . 0.0 112.447 -178.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -143.82 139.83 29.53 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 121.357 1.89 . . . . 0.0 110.997 -171.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -88.38 145.38 25.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.155 0.582 . . . . 0.0 110.294 172.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 73.6 t -114.43 -57.37 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.735 0.814 . . . . 0.0 111.426 173.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.09 -174.79 43.83 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 123.981 0.8 . . . . 0.0 112.509 -172.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.73 132.61 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.588 0.755 . . . . 0.0 112.118 -173.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.08 0.19 14.04 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 115.287 0.875 . . . . 0.0 115.287 -173.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 96.2 p -173.81 167.83 4.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.684 2.794 . . . . 0.0 110.321 -172.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.1 m . . . . . 0 CA--C 1.54 0.591 0 C-N-CA 125.122 1.369 . . . . 0.0 110.707 172.603 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 p30 . . . . . 0 CA--C 1.541 0.617 0 CA-C-O 123.259 1.504 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.2 t-105 -55.97 -33.61 64.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.066 1.746 . . . . 0.0 112.863 171.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -44.52 92.71 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.09 -1.006 . . . . 0.0 111.039 -178.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.8 p -81.49 -24.7 36.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.503 1.521 . . . . 0.0 114.563 173.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -51.3 -43.59 61.71 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.211 1.404 . . . . 0.0 112.126 174.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -57.89 -63.08 1.37 Allowed 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 124.596 1.158 . . . . 0.0 110.922 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -21.52 53.29 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -65.98 -48.74 70.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.354 1.461 . . . . 0.0 114.431 174.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -152.36 19.96 0.64 Allowed 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.1 mt -125.63 149.98 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.768 1.627 . . . . 0.0 108.527 177.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -144.51 156.86 44.37 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.453 0.644 . . . . 0.0 112.532 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -93.0 4.35 54.16 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.716 1.606 . . . . 0.0 112.16 169.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 t -160.73 111.76 1.83 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.647 1.979 . . . . 0.0 111.015 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.0 ttp85 -67.08 101.72 0.91 Allowed 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.564 -1.335 . . . . 0.0 110.557 172.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -113.85 4.42 15.87 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.654 1.582 . . . . 0.0 113.2 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.5 p -72.43 141.67 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.682 1.193 . . . . 0.0 112.427 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -128.7 7.94 5.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.476 1.91 . . . . 0.0 112.698 172.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.5 m 49.87 47.12 23.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.054 2.542 . . . . 0.0 113.685 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -163.0 -28.46 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.029 2.531 . . . . 0.0 111.86 179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -105.93 0.7 26.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.465 1.506 . . . . 0.0 113.853 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 pt -60.94 -11.69 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.035 1.334 . . . . 0.0 113.686 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -23.69 28.85 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.3 p -96.11 -4.9 41.99 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.5 p -97.04 -176.01 3.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.824 1.65 . . . . 0.0 111.476 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -64.75 -18.02 64.67 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 170.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -92.7 11.79 25.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.99 1.716 . . . . 0.0 114.145 -169.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -63.57 -8.46 9.78 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.823 2.449 . . . . 0.0 115.229 -175.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -62.75 -7.44 4.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.504 1.921 . . . . 0.0 114.71 -173.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.2 t 38.38 61.24 1.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.947 2.099 . . . . 0.0 113.653 -166.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 161.23 26.98 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.881 1.273 . . . . 0.0 112.11 160.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.25 -32.25 73.55 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.512 1.525 . . . . 0.0 114.525 -172.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -161.84 160.2 27.83 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 169.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -135.03 118.69 17.06 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.836 0.854 . . . . 0.0 110.888 171.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 25.8 m -81.84 95.55 7.35 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.036 0.534 . . . . 0.0 109.708 172.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 -80.94 131.05 35.31 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.811 -0.556 . . . . 0.0 111.892 175.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.2 mt -106.76 115.24 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 125.38 1.472 . . . . 0.0 107.779 173.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -88.21 92.53 9.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.044 0.449 . . . . 0.0 109.89 167.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.2 t -147.44 -173.7 4.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.635 1.174 . . . . 0.0 112.999 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -99.91 162.53 20.75 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 128.368 2.667 . . . . 0.0 110.995 172.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.0 -25.23 23.11 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.431 2.087 . . . . 0.0 114.244 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -58.41 18.36 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.036 -177.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -69.3 0.35 5.42 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.336 2.69 . . . . 0.0 114.831 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.5 t -102.33 -58.66 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.85 2.06 . . . . 0.0 110.001 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.27 -38.86 82.17 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.319 -0.863 . . . . 0.0 112.777 -177.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.99 -4.49 47.29 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.5 mt -53.23 -35.02 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.858 0.754 . . . . 0.0 110.798 170.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.7 p -113.24 158.08 20.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.005 1.322 . . . . 0.0 113.077 174.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -153.93 104.73 2.69 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.942 1.697 . . . . 0.0 110.373 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.84 4.97 88.41 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.206 0.908 . . . . 0.0 114.986 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.4 mt -76.35 118.82 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 118.607 1.203 . . . . 0.0 111.131 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 3.3 mt -115.69 -6.36 11.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 126.943 2.097 . . . . 0.0 110.829 173.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.04 7.93 4.41 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.383 2.273 . . . . 0.0 115.682 -172.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 85.2 p 50.43 61.48 3.18 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.867 1.667 . . . . 0.0 113.912 -174.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -157.58 154.17 28.07 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 126.284 1.833 . . . . 0.0 110.54 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -137.99 -169.81 2.64 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.095 -1.003 . . . . 0.0 111.63 166.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.4 p -122.63 144.38 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.671 1.588 . . . . 0.0 109.354 169.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.6 tp -52.51 141.79 19.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.526 1.131 . . . . 0.0 111.49 169.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.31 172.25 1.57 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 121.923 0.868 . . . . 0.0 113.265 172.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.3 t -117.67 -30.69 5.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.817 1.247 . . . . 0.0 113.263 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.6 m -78.85 170.72 16.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.464 1.506 . . . . 0.0 112.15 177.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -118.51 108.12 14.61 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.577 1.151 . . . . 0.0 111.063 -176.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -100.8 161.55 13.52 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.61 1.564 . . . . 0.0 110.324 -173.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -70.38 108.34 4.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.735 -0.603 . . . . 0.0 110.125 179.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.35 130.4 47.52 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 124.695 1.198 . . . . 0.0 111.888 -175.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.9 t -135.93 95.36 3.2 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.096 0.959 . . . . 0.0 110.85 -172.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -86.54 162.56 17.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.723 0.773 . . . . 0.0 111.162 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.72 135.15 16.08 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.482 1.113 . . . . 0.0 108.975 157.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -120.46 130.43 54.3 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.063 1.345 . . . . 0.0 110.442 -176.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.5 145.54 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 124.006 0.922 . . . . 0.0 111.925 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.8 t -135.41 78.21 1.71 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.681 1.192 . . . . 0.0 112.354 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.253 1.254 0 C-N-CA 126.185 1.794 . . . . 0.0 112.924 172.853 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo . . . . . 0 CA--C 1.538 0.721 0 N-CA-C 113.329 0.473 . . . . 0.0 113.329 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.38 179.67 6.65 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.224 2.209 . . . . 0.0 110.275 -176.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -109.87 127.52 54.76 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.237 1.415 . . . . 0.0 110.373 175.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -137.91 163.62 31.02 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.531 1.132 . . . . 0.0 113.36 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.1 mtpt -104.24 157.63 17.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.59 2.356 . . . . 0.0 111.626 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.58 113.7 25.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.385 1.874 . . . . 0.0 110.84 -177.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -136.13 102.63 5.07 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.842 1.257 . . . . 0.0 113.092 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -102.61 146.07 28.72 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.285 1.434 . . . . 0.0 111.368 173.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.1 m -145.69 169.69 17.97 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.227 1.811 . . . . 0.0 111.183 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.5 m -144.44 104.32 4.06 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 120.87 -1.144 . . . . 0.0 111.039 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.34 173.12 5.83 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.02 1.328 . . . . 0.0 113.163 -170.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.61 175.63 1.04 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.359 2.264 . . . . 0.0 114.315 169.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -143.66 144.76 32.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.221 1.809 . . . . 0.0 111.755 177.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.5 t -104.6 141.32 36.62 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.446 1.098 . . . . 0.0 110.847 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.6 m -148.24 -178.31 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.024 1.73 . . . . 0.0 111.738 -173.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -127.98 115.82 19.11 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.129 1.372 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.67 132.62 34.12 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.545 0.738 . . . . 0.0 111.857 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -135.85 117.2 14.64 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.441 1.496 . . . . 0.0 108.453 173.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 56.45 56.29 5.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.744 1.218 . . . . 0.0 112.357 -171.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 65.21 25.21 12.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 127.496 2.318 . . . . 0.0 115.038 169.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.93 132.34 5.21 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.784 1.234 . . . . 0.0 109.723 -174.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.71 109.81 2.97 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.595 2.863 . . . . 0.0 113.468 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.2 m -108.84 17.19 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.606 1.963 . . . . 0.0 112.686 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -153.8 144.67 22.67 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.635 -1.29 . . . . 0.0 111.871 174.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -88.25 149.23 23.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.574 0.749 . . . . 0.0 110.056 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 81.9 t -124.5 -45.86 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.657 0.783 . . . . 0.0 112.515 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.29 -179.39 48.23 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 118.98 0.809 . . . . 0.0 114.12 -175.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 p -132.36 118.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.54 1.536 . . . . 0.0 110.704 -172.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.21 2.28 58.59 Favored Glycine 0 CA--C 1.541 1.694 0 C-N-CA 124.139 0.876 . . . . 0.0 114.909 -172.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 94.0 p -173.77 169.19 4.23 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.466 2.706 . . . . 0.0 110.097 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.7 m . . . . . 0 CA--C 1.538 0.506 0 C-N-CA 124.888 1.275 . . . . 0.0 109.085 165.264 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 CA--C 1.542 0.64 0 CA-C-O 122.462 1.125 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -60.05 -34.81 73.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.732 1.613 . . . . 0.0 113.075 177.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -44.38 96.62 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.578 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.0 p -79.54 -26.76 41.36 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -52.38 -43.23 64.61 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.858 1.663 . . . . 0.0 112.889 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -57.46 -61.45 2.48 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.409 1.084 . . . . 0.0 110.813 174.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.52 -26.95 56.22 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -49.75 68.74 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.313 1.445 . . . . 0.0 114.441 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -149.57 20.57 0.92 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -174.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -127.85 147.48 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.323 . . . . 0.0 109.566 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.12 154.58 43.33 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -87.63 0.68 55.32 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.05 1.74 . . . . 0.0 112.54 167.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.5 t -164.02 105.02 0.9 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.364 1.866 . . . . 0.0 111.202 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.2 ttp85 -67.41 105.81 1.91 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.558 -1.339 . . . . 0.0 110.934 173.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -117.75 3.75 12.28 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.527 1.531 . . . . 0.0 113.116 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.9 t -79.01 143.27 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.799 1.24 . . . . 0.0 111.66 -175.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -131.96 6.42 4.28 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.746 1.619 . . . . 0.0 113.313 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.2 m 50.43 46.72 24.98 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.838 2.055 . . . . 0.0 113.751 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -152.34 -29.14 0.16 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 127.118 2.167 . . . . 0.0 113.049 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -105.05 -2.72 24.05 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.307 1.443 . . . . 0.0 113.733 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -60.26 -12.52 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.656 1.582 . . . . 0.0 114.304 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -32.34 56.16 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.911 0.884 . . . . 0.0 112.018 167.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.8 t -88.7 -6.44 57.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.781 1.632 . . . . 0.0 114.461 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.4 p -109.73 -174.52 2.52 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.209 1.403 . . . . 0.0 112.191 -176.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -62.04 -20.83 64.38 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 120.917 -1.115 . . . . 0.0 113.618 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -94.67 17.4 13.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.157 1.783 . . . . 0.0 113.509 -169.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -67.57 -8.44 34.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.479 2.312 . . . . 0.0 114.72 -172.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -62.15 -3.62 1.36 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.973 2.509 . . . . 0.0 115.312 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.5 t 52.33 34.23 14.48 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.254 2.222 . . . . 0.0 115.054 176.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.26 164.31 5.53 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.503 1.921 . . . . 0.0 113.453 171.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -62.99 -39.59 95.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.948 1.299 . . . . 0.0 113.979 -173.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -161.02 164.79 30.69 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.487 1.515 . . . . 0.0 112.631 171.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -131.4 147.19 52.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.276 1.03 . . . . 0.0 109.952 164.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 47.3 m -107.3 92.55 4.12 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.183 1.393 . . . . 0.0 109.436 176.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -80.16 124.83 29.13 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.695 0.798 . . . . 0.0 111.708 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.0 mt -99.68 117.55 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.769 1.628 . . . . 0.0 108.432 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -87.56 86.35 7.2 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.573 -0.704 . . . . 0.0 110.53 169.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.0 m -142.9 156.96 45.0 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.381 1.473 . . . . 0.0 112.965 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -71.47 162.94 70.09 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 124.699 1.199 . . . . 0.0 110.585 163.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.02 -23.39 29.65 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.076 1.851 . . . . 0.0 114.52 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -61.25 -57.64 24.34 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.059 -0.972 . . . . 0.0 113.036 -177.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.68 0.32 5.75 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.035 2.49 . . . . 0.0 114.949 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.8 t -102.78 -54.45 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.527 1.931 . . . . 0.0 109.813 176.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -45.6 76.86 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.214 -0.929 . . . . 0.0 112.712 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.96 -2.93 32.8 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 -172.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.34 -36.23 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.501 0.72 . . . . 0.0 110.376 169.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.09 158.24 17.58 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.218 1.007 . . . . 0.0 113.172 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -155.97 101.51 2.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.129 1.771 . . . . 0.0 109.992 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 2.98 79.86 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.58 1.086 . . . . 0.0 114.88 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.2 mt -73.52 116.07 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.615 1.207 . . . . 0.0 111.249 -178.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.4 mt -108.8 -13.11 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 110.874 171.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.67 5.64 2.99 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 127.623 2.369 . . . . 0.0 116.298 -169.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.9 t 52.08 64.34 1.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.446 1.499 . . . . 0.0 112.661 -172.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -155.02 160.43 41.05 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.992 1.717 . . . . 0.0 111.262 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -144.67 -166.73 2.47 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.682 -1.262 . . . . 0.0 111.509 163.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.62 148.68 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 125.654 1.582 . . . . 0.0 109.589 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.01 142.16 25.87 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 111.476 168.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.27 172.67 2.36 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 122.558 1.17 . . . . 0.0 113.46 171.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 18.1 p -115.89 -36.83 4.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.407 1.883 . . . . 0.0 112.93 -176.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.1 m -74.52 171.7 13.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.556 1.942 . . . . 0.0 112.708 177.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -119.54 105.01 10.81 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.588 1.155 . . . . 0.0 111.31 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -98.29 162.6 13.1 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.866 1.666 . . . . 0.0 110.309 -175.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -71.51 107.38 4.38 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.726 -0.609 . . . . 0.0 110.11 177.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -100.58 129.76 46.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.49 1.116 . . . . 0.0 111.53 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 29.5 t -130.28 94.11 3.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.436 1.494 . . . . 0.0 109.497 -172.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -87.95 164.23 15.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.398 1.094 . . . . 0.0 110.663 170.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 11.5 m -129.57 168.29 16.63 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.958 1.303 . . . . 0.0 109.096 153.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -144.43 124.21 13.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.168 -0.958 . . . . 0.0 109.632 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.6 p -55.07 146.15 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 123.916 0.887 . . . . 0.0 112.473 177.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -131.85 80.65 1.93 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.283 1.433 . . . . 0.0 111.003 174.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.2 m . . . . . 0 C--O 1.253 1.276 0 C-N-CA 127.266 2.226 . . . . 0.0 113.567 178.655 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 118.557 -0.735 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.74 -52.54 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.765 1.643 . . . . 0.0 113.07 -176.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.26 178.21 7.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.417 1.887 . . . . 0.0 110.391 -176.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -105.64 126.81 52.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.641 1.177 . . . . 0.0 110.28 -178.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -133.48 155.99 48.56 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.874 1.27 . . . . 0.0 111.694 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -100.67 153.63 19.27 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.865 1.666 . . . . 0.0 112.302 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.37 112.48 19.37 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.702 1.601 . . . . 0.0 111.788 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -132.34 119.54 20.86 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.851 1.66 . . . . 0.0 110.936 174.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -132.08 150.2 52.22 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.516 1.526 . . . . 0.0 110.895 171.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.9 t -149.93 174.92 12.15 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.163 1.385 . . . . 0.0 111.705 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -141.18 104.03 4.55 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.417 -0.802 . . . . 0.0 111.004 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -165.91 173.16 10.8 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.947 1.299 . . . . 0.0 113.038 -172.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.7 173.2 2.94 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.856 2.063 . . . . 0.0 113.427 169.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -143.15 155.88 44.66 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.402 1.881 . . . . 0.0 110.422 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.9 t -113.62 145.94 40.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.237 1.415 . . . . 0.0 111.778 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -148.67 -179.3 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 126.314 1.845 . . . . 0.0 111.774 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.9 m -124.85 119.15 28.02 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.273 1.429 . . . . 0.0 111.893 174.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.5 t -85.44 131.15 34.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.508 1.123 . . . . 0.0 111.5 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -139.53 112.53 8.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.489 1.116 . . . . 0.0 109.303 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 58.66 58.22 3.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.33 1.452 . . . . 0.0 112.421 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.44 25.55 13.35 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.583 2.353 . . . . 0.0 114.83 169.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.46 134.91 5.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.093 1.357 . . . . 0.0 109.701 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.29 111.06 3.19 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.696 2.931 . . . . 0.0 113.705 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.3 m -109.85 16.09 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 126.35 1.86 . . . . 0.0 112.761 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -152.64 137.01 16.67 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.712 -1.242 . . . . 0.0 110.621 177.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -79.72 152.41 29.89 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 168.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.1 t -126.67 -47.53 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.594 0.758 . . . . 0.0 112.824 174.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.45 -174.69 46.89 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.474 1.034 . . . . 0.0 115.103 -175.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 41.3 t -125.75 121.25 59.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 109.799 -174.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 63.74 4.39 10.17 Favored Glycine 0 CA--C 1.542 1.768 0 N-CA-C 115.981 1.152 . . . . 0.0 115.981 -175.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -168.32 163.98 12.95 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.747 2.419 . . . . 0.0 110.54 -177.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.7 m -105.77 113.2 26.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.05 1.74 . . . . 0.0 111.129 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.0 119.7 5.28 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.007 1.289 . . . . 0.0 112.637 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.1 m -56.49 135.47 54.37 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.353 1.861 . . . . 0.0 113.559 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -103.92 14.61 52.54 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.68 1.609 . . . . 0.0 115.62 -173.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.2 32.76 0.94 Allowed Glycine 0 CA--C 1.54 1.636 0 C-N-CA 126.596 2.046 . . . . 0.0 116.591 -172.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 75.4 m -134.7 167.55 20.64 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.638 1.975 . . . . 0.0 111.928 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.91 15.22 6.48 Favored Glycine 0 CA--C 1.54 1.6 0 C-N-CA 125.665 1.602 . . . . 0.0 116.087 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 66.0 mt -64.53 139.5 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 126.048 1.739 . . . . 0.0 110.657 -176.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -139.06 17.87 2.62 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.71 1.604 . . . . 0.0 113.06 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.7 mt -75.41 -17.87 60.07 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.845 -1.159 . . . . 0.0 112.59 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -74.25 170.32 15.81 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.882 1.673 . . . . 0.0 112.942 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 91.4 m -74.48 -25.93 59.69 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.467 -0.771 . . . . 0.0 112.966 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.3 p 42.83 62.5 1.75 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.061 2.144 . . . . 0.0 114.626 -177.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.0 mp -65.44 -4.22 5.42 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 114.9 1.445 . . . . 0.0 114.9 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.5 p -60.7 -39.63 89.24 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.078 1.351 . . . . 0.0 114.033 174.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -119.3 108.73 14.97 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.117 1.367 . . . . 0.0 111.003 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.24 0.33 61.53 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.098 1.332 . . . . 0.0 115.201 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.1 m -137.53 -169.47 2.53 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.035 1.417 . . . . 0.0 111.408 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -154.55 172.18 18.23 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.879 1.672 . . . . 0.0 109.64 -174.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.5 t-105 -55.59 -37.22 67.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.826 1.65 . . . . 0.0 111.274 167.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -26.24 63.52 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.212 1.805 . . . . 0.0 113.123 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.8 p -107.8 -24.55 11.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.653 1.581 . . . . 0.0 113.815 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -50.19 -42.29 50.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.476 1.91 . . . . 0.0 112.666 171.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -56.22 -63.03 1.32 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.698 1.199 . . . . 0.0 110.785 173.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -58.87 -27.02 64.78 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -62.36 -54.12 45.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.667 1.187 . . . . 0.0 113.141 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.8 p80 -147.75 22.64 1.13 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -176.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -124.8 150.03 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.532 -1.355 . . . . 0.0 109.446 175.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.7 t -145.19 150.73 37.26 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -84.08 -1.14 54.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.572 1.549 . . . . 0.0 112.92 168.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -162.43 108.2 1.22 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.271 1.829 . . . . 0.0 111.312 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -68.35 108.84 3.38 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.219 -1.55 . . . . 0.0 110.806 172.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -114.45 5.78 15.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.646 1.578 . . . . 0.0 112.569 171.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -74.5 136.09 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.258 1.423 . . . . 0.0 111.562 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -125.56 3.83 7.59 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.054 1.741 . . . . 0.0 113.147 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 21.6 m 56.83 30.96 18.72 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.151 2.18 . . . . 0.0 114.651 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -146.09 -19.03 0.45 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.334 2.654 . . . . 0.0 112.929 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.31 -2.59 16.64 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.793 1.637 . . . . 0.0 113.478 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.5 pt -65.36 -4.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 125.505 1.522 . . . . 0.0 114.021 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 23.4 ptm -54.22 -28.01 38.21 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.524 1.129 . . . . 0.0 113.665 159.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.5 t -87.69 -26.94 22.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.444 1.497 . . . . 0.0 113.458 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.7 p -87.94 -178.55 6.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.866 1.266 . . . . 0.0 111.934 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -65.47 -16.0 63.21 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.932 -1.105 . . . . 0.0 113.634 176.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -90.75 19.07 5.75 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.485 1.914 . . . . 0.0 113.929 -173.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -67.47 -7.84 28.75 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.025 2.13 . . . . 0.0 114.348 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -61.99 -0.87 0.55 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 128.239 2.616 . . . . 0.0 115.882 -173.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 t 49.57 51.63 16.06 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.112 1.765 . . . . 0.0 113.182 -176.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 167.35 2.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.896 1.278 . . . . 0.0 112.52 170.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -76.78 -30.03 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.833 1.253 . . . . 0.0 112.622 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.31 169.32 17.64 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.711 2.004 . . . . 0.0 111.325 168.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -143.95 161.86 37.64 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.045 0.938 . . . . 0.0 110.396 159.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.6 m -124.01 92.3 3.64 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.153 1.381 . . . . 0.0 110.247 -177.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -78.6 121.51 24.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.248 1.019 . . . . 0.0 111.262 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.3 mt -94.43 116.05 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 124.759 1.224 . . . . 0.0 107.962 171.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -86.64 90.77 8.37 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.662 -0.649 . . . . 0.0 109.83 167.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 57.7 p -145.52 170.72 15.84 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.132 1.373 . . . . 0.0 112.494 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -78.25 163.46 61.97 Favored Pre-proline 0 N--CA 1.475 0.792 0 C-N-CA 124.367 1.067 . . . . 0.0 109.951 164.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.68 -24.44 18.42 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.167 1.912 . . . . 0.0 113.987 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.85 -55.39 46.16 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.328 -177.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.32 -1.73 8.61 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.097 2.531 . . . . 0.0 114.844 179.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 t -99.01 -54.69 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 126.212 1.805 . . . . 0.0 109.54 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.22 -45.59 80.18 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.766 0.827 . . . . 0.0 112.887 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.26 -3.72 38.05 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -171.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.0 mt -54.36 -35.46 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 123.456 0.703 . . . . 0.0 110.507 171.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 p -109.32 158.34 17.98 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.761 1.224 . . . . 0.0 113.17 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -155.92 108.44 2.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.941 1.696 . . . . 0.0 110.561 177.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.01 1.48 86.71 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 124.533 1.063 . . . . 0.0 114.977 -178.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -75.1 119.88 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.932 1.293 . . . . 0.0 111.298 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.16 -13.05 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 126.624 1.97 . . . . 0.0 110.993 173.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.86 3.68 4.97 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 127.428 2.291 . . . . 0.0 116.46 -168.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 54.08 64.55 1.79 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.469 1.507 . . . . 0.0 112.601 -172.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -158.66 152.04 22.91 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.601 1.96 . . . . 0.0 110.486 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -136.63 -169.32 2.43 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.906 -1.121 . . . . 0.0 110.835 163.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.3 p -122.71 150.82 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 125.314 1.446 . . . . 0.0 109.185 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.3 tp -50.91 138.91 18.18 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.841 0.856 . . . . 0.0 111.255 167.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.45 176.06 0.68 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.053 0.941 . . . . 0.0 111.679 173.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -117.65 -26.99 6.4 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.788 -1.195 . . . . 0.0 113.936 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -87.9 169.32 12.12 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.394 1.477 . . . . 0.0 112.38 -174.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -114.3 103.53 11.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.051 -1.031 . . . . 0.0 111.667 -174.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -98.96 158.42 15.66 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.172 1.789 . . . . 0.0 110.422 -176.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.93 106.54 3.68 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.763 -0.586 . . . . 0.0 110.549 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -95.56 123.2 38.99 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.202 1.001 . . . . 0.0 111.662 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.6 t -123.19 88.51 2.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.903 1.681 . . . . 0.0 110.927 -174.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -81.19 162.64 23.52 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.785 0.802 . . . . 0.0 111.693 168.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -152.26 127.87 10.09 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 125.104 1.362 . . . . 0.0 108.251 162.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -119.96 137.46 54.05 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.801 1.24 . . . . 0.0 110.001 -173.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.6 t -61.52 148.14 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-O 121.514 0.673 . . . . 0.0 112.365 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.9 t -137.18 94.39 2.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.081 1.352 . . . . 0.0 110.996 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.171 1.788 . . . . 0.0 112.506 178.558 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.21 -46.78 0.28 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 121.732 1.621 . . . . 0.0 113.107 -167.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.12 171.91 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.91 2.084 . . . . 0.0 109.619 -177.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -102.33 129.7 48.85 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.285 1.034 . . . . 0.0 110.31 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -133.31 156.26 47.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 111.871 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.97 151.98 20.72 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.074 1.35 . . . . 0.0 112.457 175.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -74.6 120.96 20.86 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.713 1.605 . . . . 0.0 111.805 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -142.24 116.12 9.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.927 1.691 . . . . 0.0 110.207 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -133.22 147.43 51.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.924 1.69 . . . . 0.0 111.002 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.7 t -154.51 175.23 13.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.544 1.538 . . . . 0.0 111.549 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -139.41 101.19 4.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.473 1.109 . . . . 0.0 110.318 171.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.02 179.54 7.91 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.592 1.157 . . . . 0.0 113.52 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.1 170.98 10.39 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 128.336 2.654 . . . . 0.0 113.732 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -142.35 141.3 32.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.06 1.744 . . . . 0.0 112.008 -176.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.6 t -102.09 142.66 33.0 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.038 0.923 . . . . 0.0 111.619 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.4 m -147.24 -178.7 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.559 1.944 . . . . 0.0 111.241 -175.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.0 m -125.72 117.71 24.05 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.177 -0.952 . . . . 0.0 111.525 174.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.09 131.51 34.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.783 0.833 . . . . 0.0 111.413 174.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -140.32 111.44 7.08 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.126 1.37 . . . . 0.0 108.562 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 59.9 56.79 3.33 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.409 1.484 . . . . 0.0 112.456 -169.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.41 24.66 13.24 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.723 2.409 . . . . 0.0 115.102 169.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.66 133.05 5.69 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 125.142 1.377 . . . . 0.0 109.445 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -76.42 105.55 2.1 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.874 3.05 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 5.7 m -101.96 15.46 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.714 1.606 . . . . 0.0 112.102 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -156.79 146.45 20.73 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 120.216 1.371 . . . . 0.0 112.759 -175.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -101.12 135.62 42.3 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.601 1.16 . . . . 0.0 111.391 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 99.6 t -110.16 -53.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.016 0.926 . . . . 0.0 112.018 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.53 -174.23 45.35 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 119.006 0.821 . . . . 0.0 114.459 -174.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 t -123.54 127.62 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 109.511 -176.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.82 4.51 7.34 Favored Glycine 0 CA--C 1.542 1.777 0 N-CA-C 116.376 1.311 . . . . 0.0 116.376 -176.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.3 t -167.87 160.82 12.65 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.269 2.228 . . . . 0.0 111.111 -175.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 86.9 m -108.27 107.74 18.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.222 1.809 . . . . 0.0 110.998 172.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.28 67.77 3.56 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.921 1.248 . . . . 0.0 113.785 -176.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.6 t -69.37 157.18 37.54 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.599 1.16 . . . . 0.0 112.589 174.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.87 -168.99 31.56 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 125.259 1.409 . . . . 0.0 115.066 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 125.51 -99.35 0.56 Allowed Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.741 1.639 . . . . 0.0 113.283 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.9 p -147.58 165.77 29.35 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.706 1.602 . . . . 0.0 112.594 -174.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.09 48.98 3.67 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 126.013 1.768 . . . . 0.0 115.411 -171.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.6 mm -75.0 145.44 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 125.655 1.582 . . . . 0.0 110.992 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 25.7 p90 -138.28 7.68 2.64 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.893 1.677 . . . . 0.0 113.66 -178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.1 mt -73.16 -13.15 61.11 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.002 1.721 . . . . 0.0 113.298 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -67.12 165.25 16.28 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.467 1.507 . . . . 0.0 113.376 179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 49.2 m -68.1 -33.94 75.47 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.805 0.842 . . . . 0.0 111.967 174.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.8 t 46.45 59.36 3.9 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.418 1.887 . . . . 0.0 113.544 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -55.25 -15.85 2.77 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.03 1.732 . . . . 0.0 115.017 -177.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.3 t -53.5 -31.69 47.12 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.989 1.716 . . . . 0.0 113.633 166.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.19 111.22 15.63 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.77 1.628 . . . . 0.0 111.111 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.92 5.02 71.49 Favored Glycine 0 CA--C 1.539 1.579 0 C-N-CA 124.539 1.066 . . . . 0.0 115.205 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.01 -167.25 2.18 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.219 1.408 . . . . 0.0 111.343 172.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -153.48 172.77 16.62 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.762 1.625 . . . . 0.0 110.126 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -56.24 -37.95 70.45 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.613 1.965 . . . . 0.0 111.875 166.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.1 90.29 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.941 1.297 . . . . 0.0 111.797 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.6 p -83.1 -30.84 27.64 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.316 1.446 . . . . 0.0 113.411 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -53.27 -38.68 63.29 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.68 1.592 . . . . 0.0 113.111 176.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -59.29 -62.73 1.67 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.744 0.818 . . . . 0.0 110.702 171.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -58.62 -23.94 59.98 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -64.35 -48.06 76.95 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.376 1.87 . . . . 0.0 113.257 177.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -155.15 25.19 0.42 Allowed 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.688 1.736 . . . . 0.0 115.688 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.3 mt -128.8 147.78 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.111 -1.618 . . . . 0.0 109.612 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.3 t -146.99 159.38 43.63 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -96.46 4.1 52.35 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 126.626 1.97 . . . . 0.0 112.494 168.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.0 t -161.98 115.76 1.85 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.305 1.842 . . . . 0.0 110.898 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttp-105 -67.36 106.2 2.01 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.574 -1.329 . . . . 0.0 110.724 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -115.51 3.56 14.07 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.293 1.437 . . . . 0.0 113.567 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 p -72.18 143.51 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.708 1.203 . . . . 0.0 112.368 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -130.38 6.54 4.87 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.06 1.744 . . . . 0.0 112.782 170.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.6 m 51.5 38.62 22.63 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.843 2.457 . . . . 0.0 113.962 -177.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -154.67 -27.76 0.12 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.112 2.565 . . . . 0.0 112.895 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -107.61 1.69 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.771 1.629 . . . . 0.0 113.527 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.2 pt -59.86 -13.46 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.43 1.492 . . . . 0.0 113.662 176.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -53.77 -26.05 21.82 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.065 1.346 . . . . 0.0 114.259 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -91.3 -13.23 32.99 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.082 1.353 . . . . 0.0 113.645 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.6 p -93.45 -176.0 3.97 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.792 1.637 . . . . 0.0 112.051 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -64.19 -18.39 64.45 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 169.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -93.16 11.36 28.07 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.011 1.724 . . . . 0.0 114.261 -167.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -64.98 -6.33 8.3 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 128.764 2.825 . . . . 0.0 115.01 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -62.35 -2.39 1.01 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.845 2.058 . . . . 0.0 114.805 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t 53.84 34.04 18.41 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.456 1.902 . . . . 0.0 113.874 -175.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 155.63 12.24 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.881 1.672 . . . . 0.0 112.242 174.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -71.13 -26.67 63.11 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.4 pttt -164.82 165.83 20.22 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 112.236 167.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -137.41 163.65 30.55 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.199 1.0 . . . . 0.0 111.554 166.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.0 m -127.76 92.1 3.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.275 1.43 . . . . 0.0 110.0 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.56 122.86 25.21 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.774 0.83 . . . . 0.0 110.848 175.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.9 mt -99.59 116.23 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.035 1.334 . . . . 0.0 107.812 174.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -89.37 87.35 7.07 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.313 0.578 . . . . 0.0 110.539 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 93.8 p -148.94 166.39 28.75 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.136 1.375 . . . . 0.0 112.602 171.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 30.1 mtt85 -74.17 161.72 77.08 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 124.715 1.206 . . . . 0.0 111.528 170.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.51 -22.32 38.8 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.305 2.003 . . . . 0.0 114.457 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -58.01 17.04 Favored Pre-proline 0 N--CA 1.473 0.72 0 CA-C-N 119.605 1.093 . . . . 0.0 112.714 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.77 -0.57 5.49 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 123.138 2.559 . . . . 0.0 114.94 178.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.4 t -101.14 -55.56 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 126.426 1.89 . . . . 0.0 109.7 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -45.53 81.26 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.087 -1.008 . . . . 0.0 112.971 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.59 -2.9 31.35 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -172.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.3 mt -53.44 -35.63 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.664 0.786 . . . . 0.0 110.468 169.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.5 p -110.38 159.23 17.65 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.63 1.172 . . . . 0.0 113.235 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -156.44 103.11 2.12 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.162 1.785 . . . . 0.0 110.005 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.5 3.55 81.17 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.596 1.093 . . . . 0.0 114.961 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.4 mt -75.31 116.48 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 118.63 1.215 . . . . 0.0 111.241 -178.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.4 mt -110.37 -13.44 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.516 1.926 . . . . 0.0 111.079 173.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.74 2.62 5.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 127.38 2.272 . . . . 0.0 116.298 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t 52.27 67.58 0.95 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.79 1.636 . . . . 0.0 112.507 -170.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -155.14 156.47 35.81 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.646 1.978 . . . . 0.0 110.878 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -140.72 -171.93 3.34 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.752 -1.218 . . . . 0.0 111.702 162.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.0 t -123.78 139.85 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.647 1.579 . . . . 0.0 108.452 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 34.0 tp -48.44 140.31 8.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.624 1.17 . . . . 0.0 111.893 170.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.45 174.06 0.81 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 174.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.5 t -122.48 -21.59 5.71 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.803 1.241 . . . . 0.0 114.201 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.8 m -86.25 171.47 11.23 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.25 1.42 . . . . 0.0 111.765 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -119.01 109.85 16.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.107 0.963 . . . . 0.0 111.26 -176.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -105.09 159.93 15.45 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 110.295 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.74 108.83 3.56 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.153 0.502 . . . . 0.0 110.35 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.91 121.28 41.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.347 1.459 . . . . 0.0 111.202 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.6 t -125.25 90.44 3.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.106 1.363 . . . . 0.0 110.717 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -80.97 161.09 24.44 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.547 0.739 . . . . 0.0 110.864 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -150.44 134.71 17.09 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 120.937 -1.102 . . . . 0.0 108.185 156.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.99 141.03 52.14 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.051 1.34 . . . . 0.0 109.228 -174.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.5 t -63.36 148.96 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-O 121.701 0.763 . . . . 0.0 112.114 -177.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.3 t -139.68 85.94 2.07 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.955 1.302 . . . . 0.0 111.874 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.252 1.198 0 C-N-CA 126.533 1.933 . . . . 0.0 113.709 178.633 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 118.606 -0.712 . . . . 0.0 111.378 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.98 -47.53 1.77 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.138 1.892 . . . . 0.0 112.263 175.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -138.98 176.14 8.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.308 1.843 . . . . 0.0 110.353 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -95.27 127.34 41.24 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.568 1.147 . . . . 0.0 110.2 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -135.39 159.25 42.16 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.563 1.145 . . . . 0.0 111.957 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.33 151.68 25.67 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.907 1.683 . . . . 0.0 112.722 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.63 110.22 12.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.204 1.802 . . . . 0.0 111.742 -172.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -134.11 117.7 16.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.587 1.555 . . . . 0.0 111.372 177.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -132.35 151.6 51.79 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.806 1.643 . . . . 0.0 111.406 173.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -152.75 177.04 11.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.114 1.366 . . . . 0.0 112.012 176.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -144.41 103.98 4.03 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.044 0.938 . . . . 0.0 111.058 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.58 172.6 6.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.375 1.47 . . . . 0.0 113.224 -173.269 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.12 171.86 1.19 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 127.585 2.354 . . . . 0.0 114.355 168.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -142.65 146.27 34.3 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.559 1.944 . . . . 0.0 111.597 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.0 t -106.5 142.46 36.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.088 0.955 . . . . 0.0 111.63 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -147.14 -179.53 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.471 1.908 . . . . 0.0 111.697 -174.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.7 m -126.42 119.81 28.18 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.225 -0.922 . . . . 0.0 111.818 174.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.4 t -85.17 128.83 34.82 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.34 1.056 . . . . 0.0 111.341 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -136.5 113.31 10.3 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.023 1.329 . . . . 0.0 108.988 176.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 58.27 57.83 3.76 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.985 1.314 . . . . 0.0 112.453 -172.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.98 26.25 14.08 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.398 2.279 . . . . 0.0 114.763 170.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.53 134.16 5.96 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 124.94 1.296 . . . . 0.0 109.516 -177.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -75.32 105.46 2.09 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.698 2.932 . . . . 0.0 112.228 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 9.9 m -99.41 11.8 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.26 1.424 . . . . 0.0 111.968 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -155.75 142.25 18.63 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.114 1.325 . . . . 0.0 112.595 -170.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -98.02 137.6 36.59 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.391 1.076 . . . . 0.0 111.351 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.6 t -111.3 -55.49 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.133 0.973 . . . . 0.0 112.028 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.57 -173.65 43.24 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 118.983 0.811 . . . . 0.0 115.123 -171.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.9 t -127.54 124.03 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.874 1.67 . . . . 0.0 110.051 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.04 3.96 10.08 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.0 p -168.96 163.98 11.47 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.647 2.379 . . . . 0.0 110.924 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -105.44 106.43 16.93 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.112 1.365 . . . . 0.0 110.611 172.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.15 90.81 1.15 Allowed Glycine 0 CA--C 1.531 1.058 0 C-N-CA 125.436 1.493 . . . . 0.0 112.011 -178.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 t -125.24 168.05 14.01 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.044 1.338 . . . . 0.0 112.398 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.76 -176.42 45.91 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 125.395 1.474 . . . . 0.0 114.068 -172.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 116.33 -85.11 0.38 Allowed Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.579 1.561 . . . . 0.0 113.126 175.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 52.5 m -140.92 166.23 25.34 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.481 1.512 . . . . 0.0 112.493 -174.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -77.93 45.5 2.5 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 126.027 1.775 . . . . 0.0 114.76 -178.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.3 mt -70.38 142.74 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 126.06 1.744 . . . . 0.0 110.145 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -135.91 6.66 3.16 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.699 1.6 . . . . 0.0 113.725 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.4 -8.53 55.47 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.835 1.654 . . . . 0.0 112.643 178.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -59.56 167.92 1.81 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.493 1.917 . . . . 0.0 112.787 168.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.3 m -70.02 -27.19 64.47 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.417 -0.802 . . . . 0.0 112.633 178.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 91.8 p 51.26 38.86 22.51 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.533 1.933 . . . . 0.0 115.298 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.09 -24.03 9.21 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.081 1.352 . . . . 0.0 114.315 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.9 p -52.62 -31.95 39.27 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 126.562 1.945 . . . . 0.0 114.765 171.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.98 104.44 8.57 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.018 1.727 . . . . 0.0 111.919 176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.35 -3.8 50.98 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.484 1.516 . . . . 0.0 115.245 178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -131.67 -163.58 1.35 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.261 1.424 . . . . 0.0 111.134 172.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -156.1 173.39 16.89 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.926 1.691 . . . . 0.0 109.687 -175.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.4 ' NE1' ' HE3' ' A' ' 93' ' ' LYS . 3.4 t-105 -55.45 -37.94 68.4 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.705 2.002 . . . . 0.0 112.063 167.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -42.34 83.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.827 1.251 . . . . 0.0 111.329 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -87.82 -27.57 22.19 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.568 1.547 . . . . 0.0 114.084 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -50.48 -42.86 55.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.934 1.694 . . . . 0.0 112.782 173.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.67 -62.45 1.72 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.454 1.102 . . . . 0.0 110.797 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -60.31 -23.03 63.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -178.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -64.57 -52.58 56.89 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.34 1.456 . . . . 0.0 113.163 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -149.95 22.64 0.87 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -175.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -125.69 150.08 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 120.362 -1.461 . . . . 0.0 109.246 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.6 t -145.39 152.58 40.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -84.31 -1.81 55.97 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.156 1.782 . . . . 0.0 112.963 168.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -163.65 114.71 1.37 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.391 1.876 . . . . 0.0 111.178 176.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -66.59 105.87 1.64 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.348 -1.47 . . . . 0.0 110.683 173.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -115.18 1.29 13.81 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.275 1.43 . . . . 0.0 113.595 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.7 p -72.3 143.04 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.818 1.247 . . . . 0.0 112.229 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -130.77 12.66 5.31 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.123 1.769 . . . . 0.0 112.226 170.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.4 m 51.67 38.41 22.67 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.905 2.482 . . . . 0.0 112.704 -173.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -147.86 -43.01 0.16 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.808 2.443 . . . . 0.0 112.519 -168.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.4 p30 -93.0 -6.26 48.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.141 1.377 . . . . 0.0 113.347 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.9 pt -63.34 -10.78 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.509 1.124 . . . . 0.0 113.492 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -56.38 -19.78 16.38 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.887 1.275 . . . . 0.0 114.128 164.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.3 t -114.76 -2.33 13.02 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.425 1.89 . . . . 0.0 113.78 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.5 p -98.52 -174.37 2.79 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.122 1.369 . . . . 0.0 110.886 172.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -64.02 -18.08 63.97 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.801 -1.187 . . . . 0.0 113.622 173.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -94.53 14.03 22.12 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.867 1.667 . . . . 0.0 114.275 -165.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -66.32 -4.16 7.39 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 128.514 2.726 . . . . 0.0 114.922 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -62.96 -2.9 1.36 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.651 1.98 . . . . 0.0 115.16 -174.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.8 t 57.17 32.26 21.41 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.938 1.695 . . . . 0.0 113.596 -176.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.21 155.27 25.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.103 1.361 . . . . 0.0 112.334 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -64.62 -30.99 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -170.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.25 164.17 22.54 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.015 1.726 . . . . 0.0 111.407 166.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -128.78 159.26 36.25 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.184 0.593 . . . . 0.0 110.159 161.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.1 m -122.05 93.51 4.01 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.828 1.251 . . . . 0.0 109.578 173.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -78.25 128.0 33.08 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.563 0.745 . . . . 0.0 111.114 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.1 mt -103.4 111.77 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.385 1.474 . . . . 0.0 107.447 173.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -80.62 88.83 5.69 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.728 -0.608 . . . . 0.0 109.69 168.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 71.1 m -149.21 159.31 44.36 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.069 1.348 . . . . 0.0 112.849 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -73.39 162.75 72.88 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 124.641 1.176 . . . . 0.0 110.35 166.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.8 -23.13 30.97 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.135 1.89 . . . . 0.0 114.428 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.97 -56.84 27.99 Favored Pre-proline 0 N--CA 1.474 0.744 0 CA-C-O 117.974 -1.013 . . . . 0.0 113.183 -176.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.69 -1.12 7.87 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.982 2.455 . . . . 0.0 114.863 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.2 t -100.81 -54.32 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.282 1.833 . . . . 0.0 109.668 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.4 ' HE3' ' NE1' ' A' ' 51' ' ' TRP . 0.0 OUTLIER -67.01 -44.79 79.41 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.225 -0.922 . . . . 0.0 112.969 -179.882 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.25 -4.2 37.62 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -172.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.7 mt -53.08 -35.22 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.876 0.87 . . . . 0.0 110.799 170.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.6 p -112.53 158.07 20.38 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.271 1.429 . . . . 0.0 113.315 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -154.83 107.79 2.81 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.56 1.944 . . . . 0.0 109.803 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.56 3.24 88.51 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.411 1.005 . . . . 0.0 114.957 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 51.1 mt -76.43 117.62 21.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.887 1.275 . . . . 0.0 111.037 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.98 -12.04 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 126.729 2.012 . . . . 0.0 110.964 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 3.7 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.325 2.25 . . . . 0.0 116.12 -170.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.26 67.93 0.9 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.736 1.614 . . . . 0.0 113.062 -171.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -158.53 153.56 25.25 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.164 1.786 . . . . 0.0 110.717 177.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -138.46 -170.91 2.93 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.822 -1.174 . . . . 0.0 111.128 165.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.0 t -125.59 139.85 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.431 1.492 . . . . 0.0 108.578 173.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.0 tp -48.77 139.72 9.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.502 1.121 . . . . 0.0 111.947 170.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.25 172.33 1.51 Allowed 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 174.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -120.09 -24.47 6.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.701 1.201 . . . . 0.0 113.996 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -82.07 172.68 12.94 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.233 1.413 . . . . 0.0 112.089 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -119.16 105.36 11.3 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.595 1.158 . . . . 0.0 111.382 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -100.61 162.29 13.03 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.0 1.72 . . . . 0.0 110.854 -174.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -73.49 105.37 4.81 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.759 -0.588 . . . . 0.0 110.506 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.83 123.09 39.25 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.741 1.216 . . . . 0.0 111.471 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 42.4 t -127.05 91.2 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.006 1.322 . . . . 0.0 110.892 -174.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -83.95 164.39 19.41 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.682 0.753 . . . . 0.0 111.591 169.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -154.2 119.87 5.21 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.192 -0.943 . . . . 0.0 109.025 161.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -107.66 139.46 42.17 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.325 1.05 . . . . 0.0 110.239 -174.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.14 149.55 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.174 0.589 . . . . 0.0 112.198 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.1 t -142.14 95.06 2.74 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 122.099 0.952 . . . . 0.0 112.667 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.864 2.066 . . . . 0.0 113.952 179.127 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 . . . . . 0 N--CA 1.488 1.438 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.767 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.45 -47.33 0.24 Allowed 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.594 1.53 . . . . 0.0 111.989 169.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -144.84 -178.11 5.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.774 2.029 . . . . 0.0 110.742 -174.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -105.45 127.08 52.8 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.352 1.461 . . . . 0.0 110.418 177.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -134.34 164.29 27.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.888 1.275 . . . . 0.0 112.23 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -116.04 153.29 31.95 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.793 2.037 . . . . 0.0 112.646 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.33 113.99 22.07 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.475 1.91 . . . . 0.0 111.577 -168.014 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -137.87 103.06 4.88 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.641 1.576 . . . . 0.0 112.424 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -117.35 140.98 48.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.079 1.351 . . . . 0.0 111.279 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -147.2 165.68 29.3 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.648 1.579 . . . . 0.0 111.484 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -140.21 103.67 4.64 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.614 -0.679 . . . . 0.0 111.209 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.48 170.7 5.72 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.803 1.241 . . . . 0.0 113.248 -169.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 171.62 1.45 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.571 2.349 . . . . 0.0 113.89 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.5 p90 -141.83 147.0 36.51 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.336 1.854 . . . . 0.0 111.453 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.6 t -105.45 144.31 32.39 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.839 0.856 . . . . 0.0 111.063 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.8 m -148.36 -178.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.336 1.855 . . . . 0.0 111.804 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -128.09 117.66 22.03 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.022 1.329 . . . . 0.0 111.877 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 18.7 t -85.32 129.43 34.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.467 1.107 . . . . 0.0 111.729 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -135.61 114.1 11.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 125.021 1.329 . . . . 0.0 109.113 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 57.46 57.25 4.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.876 1.27 . . . . 0.0 112.445 -172.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.4 26.18 13.5 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.458 2.303 . . . . 0.0 114.745 170.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.01 134.29 5.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.111 1.365 . . . . 0.0 109.709 -177.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.55 110.08 3.03 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 123.551 2.834 . . . . 0.0 113.351 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.4 m -108.01 17.03 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 126.42 1.888 . . . . 0.0 112.347 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -153.8 141.3 19.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.66 -1.275 . . . . 0.0 111.113 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -84.69 154.23 22.6 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.124 0.57 . . . . 0.0 110.274 169.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.1 t -130.1 -44.6 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.04 -174.96 47.23 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 119.74 1.155 . . . . 0.0 115.262 -174.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -130.79 116.67 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.03 1.732 . . . . 0.0 110.024 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.34 3.29 31.06 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 115.17 0.828 . . . . 0.0 115.17 -174.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 98.4 p -167.9 167.6 12.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 128.156 2.582 . . . . 0.0 110.387 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 78.4 m -107.2 119.82 40.44 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.256 1.422 . . . . 0.0 110.34 171.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.12 114.5 6.61 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.816 1.198 . . . . 0.0 112.042 174.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.6 p -61.39 138.57 58.26 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.779 1.632 . . . . 0.0 112.937 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -81.79 36.46 2.49 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.648 1.594 . . . . 0.0 115.258 -173.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -78.81 -63.79 2.04 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.932 1.253 . . . . 0.0 113.446 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.8 m -67.71 160.16 28.64 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.004 1.322 . . . . 0.0 113.323 -177.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.84 19.12 12.54 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 125.838 1.685 . . . . 0.0 116.046 -176.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 53.0 mt -63.22 133.79 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.641 1.576 . . . . 0.0 110.704 -175.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -145.36 20.53 1.54 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.542 1.537 . . . . 0.0 113.272 -178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.51 -11.96 60.13 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.589 -1.319 . . . . 0.0 112.866 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -68.11 167.62 13.69 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.844 1.657 . . . . 0.0 113.482 177.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 50.2 m -64.23 -34.17 77.48 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.357 1.063 . . . . 0.0 112.432 176.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.9 t 43.47 71.89 0.21 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.658 2.383 . . . . 0.0 114.363 -176.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.5 mp -67.6 2.8 1.63 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 126.062 1.745 . . . . 0.0 115.061 -178.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.2 t -60.96 -39.09 88.23 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.242 1.417 . . . . 0.0 113.103 177.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.05 113.69 18.09 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.243 1.417 . . . . 0.0 110.805 -175.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.54 0.8 64.5 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.922 1.248 . . . . 0.0 115.076 -177.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 18.1 m -138.36 -172.12 3.21 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.233 1.413 . . . . 0.0 111.202 175.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -153.93 173.25 16.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.794 1.638 . . . . 0.0 109.663 -175.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -56.48 -37.41 70.32 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 126.076 1.751 . . . . 0.0 111.734 168.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.63 -37.62 76.31 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.486 1.114 . . . . 0.0 111.731 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -90.94 -27.1 18.93 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.599 1.16 . . . . 0.0 113.926 175.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -51.07 -43.01 60.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 126.136 1.774 . . . . 0.0 113.036 174.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -56.4 -62.21 1.88 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.507 1.123 . . . . 0.0 110.961 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.59 -27.49 62.76 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.8 tptt -65.11 -51.02 63.74 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.019 1.328 . . . . 0.0 113.726 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -148.84 22.82 0.99 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -128.3 147.94 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.11 1.364 . . . . 0.0 109.434 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.4 t -147.88 154.36 40.3 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -85.65 1.51 48.97 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.21 1.804 . . . . 0.0 113.112 167.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.6 t -162.38 104.19 1.1 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.685 1.994 . . . . 0.0 110.953 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -67.33 109.06 2.98 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.546 -1.346 . . . . 0.0 110.121 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.81 5.69 17.64 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.305 1.442 . . . . 0.0 113.005 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -77.2 139.3 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.871 1.268 . . . . 0.0 111.898 -174.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -127.36 7.86 6.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.096 1.758 . . . . 0.0 112.819 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 m 53.03 37.26 24.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.424 2.29 . . . . 0.0 113.816 -178.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -151.03 -33.36 0.16 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.831 2.452 . . . . 0.0 111.853 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -97.52 -5.25 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.852 1.661 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.7 pt -62.32 -12.21 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.947 1.299 . . . . 0.0 113.633 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -55.68 -33.39 64.09 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.738 0.815 . . . . 0.0 112.387 168.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -77.54 -12.57 59.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.263 1.425 . . . . 0.0 114.207 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -100.49 -175.36 2.89 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.539 1.536 . . . . 0.0 112.422 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -63.34 -19.95 65.08 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -94.25 12.79 25.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.783 1.633 . . . . 0.0 114.199 -165.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -64.68 -5.79 6.47 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 128.999 2.919 . . . . 0.0 115.136 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -62.32 -2.06 0.91 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.739 2.016 . . . . 0.0 114.919 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.8 t 55.98 31.46 18.0 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.101 1.76 . . . . 0.0 113.981 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 156.81 24.37 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.847 1.659 . . . . 0.0 112.527 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -63.23 -34.13 76.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.654 1.182 . . . . 0.0 114.155 -171.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.4 ptmm? -162.64 160.57 25.87 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.913 1.685 . . . . 0.0 112.473 168.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -129.85 159.01 37.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.029 0.932 . . . . 0.0 110.152 161.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.9 m -123.7 92.73 3.74 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.164 1.386 . . . . 0.0 109.503 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -79.48 121.85 25.71 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.166 0.986 . . . . 0.0 111.168 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.9 mt -97.25 117.25 41.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.242 1.417 . . . . 0.0 107.897 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -89.05 90.81 8.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.249 0.547 . . . . 0.0 110.294 167.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.0 p -144.67 172.04 13.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.337 1.455 . . . . 0.0 112.311 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -79.3 164.27 55.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 124.434 1.094 . . . . 0.0 109.779 164.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 -22.88 22.03 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.179 1.92 . . . . 0.0 114.284 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.24 -54.97 49.92 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-O 118.018 -0.991 . . . . 0.0 113.293 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.95 -1.28 8.36 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.236 2.624 . . . . 0.0 114.785 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 15.7 t -99.7 -53.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 126.141 1.776 . . . . 0.0 109.708 175.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -45.37 78.83 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.36 -0.837 . . . . 0.0 112.869 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.36 -3.54 37.42 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.3 mt -53.83 -36.19 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 123.514 0.726 . . . . 0.0 110.491 170.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.2 p -108.92 158.04 18.07 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.798 1.239 . . . . 0.0 113.031 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -156.2 104.84 2.27 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.657 1.583 . . . . 0.0 110.785 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 1.84 81.36 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.656 1.122 . . . . 0.0 115.002 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.66 119.91 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.899 1.279 . . . . 0.0 111.237 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.3 mt -112.27 -13.19 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.591 1.956 . . . . 0.0 110.927 173.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.93 4.14 5.77 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.441 2.296 . . . . 0.0 116.341 -168.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 53.2 68.16 0.88 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.646 1.579 . . . . 0.0 112.998 -171.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -159.83 152.86 21.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.161 1.784 . . . . 0.0 110.907 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -141.65 -170.24 3.07 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.817 -1.177 . . . . 0.0 111.524 166.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.92 142.62 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.747 1.619 . . . . 0.0 108.656 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.1 tp -51.12 140.66 15.7 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.229 1.011 . . . . 0.0 111.721 168.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.77 172.93 1.46 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -118.42 -31.47 4.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.872 1.269 . . . . 0.0 113.354 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.5 m -74.3 170.54 15.39 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.701 1.601 . . . . 0.0 112.334 175.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -120.34 102.31 8.39 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.326 1.051 . . . . 0.0 111.601 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -95.27 161.57 14.04 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.081 1.752 . . . . 0.0 110.978 -175.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -74.63 101.35 4.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.726 0.81 . . . . 0.0 110.53 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -96.1 128.8 43.33 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.943 1.297 . . . . 0.0 112.3 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.9 t -129.6 96.09 4.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.783 1.633 . . . . 0.0 110.672 -173.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -94.17 157.34 16.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.845 0.831 . . . . 0.0 111.585 172.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -147.43 117.86 7.43 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.271 1.028 . . . . 0.0 109.474 167.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -106.36 138.12 43.11 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.632 1.173 . . . . 0.0 110.099 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.9 t -61.15 146.92 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.673 0.789 . . . . 0.0 111.624 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 5.7 t -137.91 88.56 2.33 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.894 1.33 . . . . 0.0 111.39 174.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.343 1.857 . . . . 0.0 112.935 175.046 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -81.1 -51.05 0.05 OUTLIER 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 122.276 1.984 . . . . 0.0 114.453 -161.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.2 m -127.62 160.4 31.74 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.171 1.788 . . . . 0.0 109.782 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.0 140.55 29.38 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.509 1.124 . . . . 0.0 110.136 173.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -138.93 159.75 41.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.057 1.343 . . . . 0.0 112.32 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -92.67 156.22 17.21 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.144 2.178 . . . . 0.0 111.948 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -89.7 113.4 24.89 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.271 1.828 . . . . 0.0 111.128 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -137.16 93.06 2.78 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.884 1.274 . . . . 0.0 111.929 174.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -109.07 136.18 49.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.017 1.327 . . . . 0.0 110.758 177.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 m -143.46 171.46 14.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.591 1.556 . . . . 0.0 111.737 -174.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -143.54 104.68 4.25 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.137 -0.977 . . . . 0.0 111.439 175.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.52 172.72 4.97 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.112 1.365 . . . . 0.0 113.332 -169.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.37 173.42 1.57 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.551 2.34 . . . . 0.0 114.233 168.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -142.88 147.53 35.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.759 2.024 . . . . 0.0 111.51 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -107.25 142.55 36.83 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.028 0.931 . . . . 0.0 111.501 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.1 m -147.98 -178.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 126.305 1.842 . . . . 0.0 111.65 -174.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.4 m -127.06 119.69 27.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.115 0.966 . . . . 0.0 111.195 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.73 132.73 34.03 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.708 0.803 . . . . 0.0 111.365 174.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -137.08 118.23 14.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.365 1.466 . . . . 0.0 108.488 174.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 56.37 55.44 6.61 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.65 1.18 . . . . 0.0 112.495 -171.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.54 25.16 11.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.675 2.39 . . . . 0.0 115.038 169.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.11 133.33 6.1 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 124.779 1.232 . . . . 0.0 109.439 -175.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.0 104.57 1.93 Allowed 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.848 3.032 . . . . 0.0 112.163 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.7 m -102.05 14.59 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.394 1.478 . . . . 0.0 112.194 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -156.59 142.59 18.0 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 120.111 1.323 . . . . 0.0 112.259 -173.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -97.58 141.19 30.92 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.258 1.023 . . . . 0.0 111.216 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 78.0 t -115.71 -53.86 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.057 0.943 . . . . 0.0 112.208 177.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.8 -172.78 42.64 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 119.122 0.874 . . . . 0.0 115.089 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -128.5 122.25 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 126.006 1.722 . . . . 0.0 110.034 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.82 1.46 12.03 Favored Glycine 0 CA--C 1.541 1.672 0 N-CA-C 115.856 1.102 . . . . 0.0 115.856 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.6 t -169.08 164.63 11.29 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.879 2.472 . . . . 0.0 110.316 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.6 m -104.58 111.54 24.26 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.841 1.657 . . . . 0.0 111.174 173.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.63 80.51 1.44 Allowed Glycine 0 CA--C 1.532 1.11 0 C-N-CA 125.101 1.334 . . . . 0.0 112.732 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -64.36 120.49 12.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.557 1.143 . . . . 0.0 111.659 174.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.8 -168.13 40.56 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 124.324 0.964 . . . . 0.0 114.329 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 161.56 -99.37 0.17 Allowed Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.683 1.135 . . . . 0.0 112.364 176.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.1 m -138.85 159.42 42.17 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.857 1.663 . . . . 0.0 111.436 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.37 40.97 2.23 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 125.602 1.572 . . . . 0.0 115.029 -175.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 25.1 mm -89.94 157.81 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.909 1.684 . . . . 0.0 110.687 -175.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -138.01 8.07 2.72 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.171 1.388 . . . . 0.0 114.197 -173.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.9 -11.45 60.0 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.065 1.346 . . . . 0.0 112.507 -178.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -64.69 164.15 12.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.577 1.151 . . . . 0.0 112.195 169.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.5 m -68.22 -33.79 75.05 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.623 -0.673 . . . . 0.0 112.168 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.5 t 48.61 59.54 4.29 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.222 1.809 . . . . 0.0 112.827 -178.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mp -60.83 -13.1 13.26 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -172.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.8 p -58.22 -30.48 66.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.062 1.745 . . . . 0.0 114.469 172.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -122.74 122.5 38.89 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.856 1.662 . . . . 0.0 111.841 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.21 14.17 82.53 Favored Glycine 0 CA--C 1.537 1.44 0 C-N-CA 124.11 0.862 . . . . 0.0 115.02 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.6 m -152.01 -178.33 6.69 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.926 2.09 . . . . 0.0 110.088 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -152.0 167.62 27.84 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.883 2.073 . . . . 0.0 110.702 -168.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.8 t-105 -54.74 -36.69 65.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.427 1.891 . . . . 0.0 112.41 170.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -26.97 68.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.753 1.221 . . . . 0.0 113.06 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.7 p -89.43 -31.6 17.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.658 1.183 . . . . 0.0 113.649 167.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.01 -39.69 72.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.89 1.676 . . . . 0.0 113.11 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -57.42 -65.43 0.63 Allowed 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.435 1.094 . . . . 0.0 110.526 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -60.67 -22.33 63.78 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -61.73 -55.09 33.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.465 1.506 . . . . 0.0 113.329 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -147.88 21.96 1.12 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -172.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.0 mt -129.22 146.84 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.095 1.358 . . . . 0.0 109.695 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.9 t -147.35 153.82 40.15 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 174.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -84.73 0.86 49.05 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.088 1.755 . . . . 0.0 113.112 168.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.2 t -161.26 105.76 1.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.529 1.932 . . . . 0.0 110.932 175.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -66.99 108.34 2.56 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.545 -1.347 . . . . 0.0 110.13 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -114.44 4.38 15.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.328 1.451 . . . . 0.0 113.026 176.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.4 t -83.4 138.04 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.133 0.973 . . . . 0.0 111.437 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -124.55 8.61 8.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.127 1.771 . . . . 0.0 112.398 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.3 m 52.03 44.64 29.37 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.385 2.274 . . . . 0.0 113.26 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -160.55 -20.07 0.06 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.201 2.2 . . . . 0.0 113.718 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -106.39 -1.98 22.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.826 1.25 . . . . 0.0 113.671 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.45 -13.72 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.434 1.493 . . . . 0.0 114.195 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 4.6 ptm -51.07 -25.11 4.53 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.23 1.412 . . . . 0.0 114.587 164.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 t -95.66 -15.58 22.62 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.663 1.585 . . . . 0.0 113.584 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 p -90.39 -174.73 4.25 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.698 1.599 . . . . 0.0 112.188 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -63.38 -20.73 65.79 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.146 -0.971 . . . . 0.0 113.572 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.27 20.01 8.7 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.606 1.963 . . . . 0.0 113.424 -170.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -65.59 -10.12 32.72 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.601 2.36 . . . . 0.0 114.537 -174.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -61.8 -3.13 1.01 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.89 2.476 . . . . 0.0 115.369 -175.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.93 25.47 6.83 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.296 1.838 . . . . 0.0 114.185 -177.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 161.3 4.27 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 113.692 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -63.98 -34.81 78.84 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.472 1.509 . . . . 0.0 114.346 -168.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -165.35 158.53 16.25 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.446 1.498 . . . . 0.0 112.421 175.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -140.43 128.23 21.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.797 1.239 . . . . 0.0 110.015 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 54.2 m -91.87 94.34 9.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.679 1.192 . . . . 0.0 110.551 171.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -79.81 125.91 30.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.243 0.617 . . . . 0.0 111.175 175.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.0 mt -99.8 114.48 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.367 1.467 . . . . 0.0 108.057 172.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -84.91 87.36 7.34 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.735 -0.603 . . . . 0.0 110.109 167.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 t -152.17 171.23 18.25 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.201 1.0 . . . . 0.0 113.138 170.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -77.07 163.85 62.6 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.975 2.11 . . . . 0.0 110.852 173.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.58 -23.2 23.48 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.347 2.031 . . . . 0.0 114.408 176.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -60.15 -57.93 23.06 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 124.605 1.162 . . . . 0.0 113.211 -177.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -70.0 -0.81 7.66 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.164 2.576 . . . . 0.0 114.813 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -100.26 -55.19 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.327 1.851 . . . . 0.0 109.549 176.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -44.2 82.39 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.224 -0.922 . . . . 0.0 112.97 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.21 -4.38 38.56 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 61.7 mt -53.17 -36.01 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.713 0.805 . . . . 0.0 110.672 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 32.0 p -110.22 159.1 17.69 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.528 1.131 . . . . 0.0 113.056 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -156.35 103.77 2.18 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.623 1.569 . . . . 0.0 110.688 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.65 3.7 85.97 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.288 0.947 . . . . 0.0 114.912 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.3 mt -74.32 115.22 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.544 1.172 . . . . 0.0 111.161 -178.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.9 mt -108.43 -14.11 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.442 1.897 . . . . 0.0 110.867 171.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.42 5.76 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.732 2.413 . . . . 0.0 116.396 -169.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.2 t 51.42 65.87 1.36 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.498 1.519 . . . . 0.0 112.862 -171.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -154.89 157.06 37.23 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.206 1.803 . . . . 0.0 111.106 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -142.29 -170.15 3.11 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.859 -1.151 . . . . 0.0 111.778 163.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.15 142.4 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.833 1.653 . . . . 0.0 108.625 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp -49.67 140.86 10.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.587 1.155 . . . . 0.0 111.945 169.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.49 172.66 1.48 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -118.06 -30.54 5.3 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.89 1.276 . . . . 0.0 113.474 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.2 m -76.91 171.5 14.66 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.801 1.64 . . . . 0.0 112.457 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -118.84 102.34 8.73 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.434 1.094 . . . . 0.0 111.667 -176.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -95.53 161.62 13.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.007 1.723 . . . . 0.0 111.135 -176.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -75.22 100.83 4.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.327 0.651 . . . . 0.0 110.537 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.24 128.99 37.28 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.203 . . . . 0.0 112.049 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 44.4 t -130.59 90.08 2.87 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 125.654 1.581 . . . . 0.0 110.074 -175.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -88.6 160.2 17.53 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.865 0.84 . . . . 0.0 111.419 171.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.3 m -147.35 142.79 27.47 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 125.586 1.554 . . . . 0.0 107.951 164.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -132.76 128.91 37.85 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.616 1.167 . . . . 0.0 109.755 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.6 t -57.77 147.22 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.962 0.905 . . . . 0.0 111.703 -176.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.65 103.61 5.28 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.158 0.983 . . . . 0.0 112.31 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.563 1.945 . . . . 0.0 113.473 179.748 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 119.129 -0.462 . . . . 0.0 111.898 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.01 -48.86 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.594 1.529 . . . . 0.0 112.538 -177.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.89 175.81 10.15 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.022 2.129 . . . . 0.0 110.119 -177.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -106.82 128.65 54.44 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.877 1.271 . . . . 0.0 110.672 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -135.22 158.19 45.01 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.78 1.232 . . . . 0.0 112.669 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.0 mtpp -89.02 155.9 19.2 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.618 2.367 . . . . 0.0 111.407 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.29 105.13 17.25 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.573 1.549 . . . . 0.0 110.513 -176.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -132.3 101.9 5.55 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.131 1.373 . . . . 0.0 112.278 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -114.08 137.51 51.63 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.608 1.563 . . . . 0.0 110.971 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.2 m -142.33 169.13 18.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.868 1.667 . . . . 0.0 111.047 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -143.54 103.79 4.14 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.077 -1.015 . . . . 0.0 111.387 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.83 172.16 6.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.799 1.24 . . . . 0.0 113.535 -170.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.81 170.28 0.43 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 128.974 2.909 . . . . 0.0 114.327 165.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.58 150.47 36.45 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.884 2.074 . . . . 0.0 111.395 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.1 t -112.29 146.25 38.55 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.845 0.831 . . . . 0.0 112.434 176.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.2 m -149.19 -177.31 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.596 1.958 . . . . 0.0 111.697 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.6 m -128.11 116.26 19.68 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 125.029 1.332 . . . . 0.0 111.908 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.5 t -83.91 130.24 34.91 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.101 0.96 . . . . 0.0 111.433 176.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -137.09 115.04 11.45 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.954 1.302 . . . . 0.0 108.969 174.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 57.53 57.31 4.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.869 1.268 . . . . 0.0 112.498 -172.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 64.4 26.1 13.48 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.254 2.222 . . . . 0.0 114.734 170.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.21 134.43 5.77 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.227 1.411 . . . . 0.0 109.528 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.498 2.799 . . . . 0.0 113.317 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.8 m -106.62 16.84 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.498 1.919 . . . . 0.0 112.566 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -153.14 142.97 22.08 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.631 -1.293 . . . . 0.0 111.322 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -84.38 154.52 22.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.986 0.514 . . . . 0.0 110.419 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.3 t -124.28 -55.49 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.571 0.749 . . . . 0.0 112.339 167.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.09 -172.34 43.25 Favored Glycine 0 CA--C 1.53 1.028 0 CA-C-N 119.028 0.831 . . . . 0.0 115.104 -170.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -127.13 123.03 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.823 1.649 . . . . 0.0 110.672 -169.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.24 1.04 8.72 Favored Glycine 0 CA--C 1.541 1.66 0 C-N-CA 124.973 1.273 . . . . 0.0 115.97 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.7 m -166.09 166.6 17.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 129.912 3.285 . . . . 0.0 108.964 -174.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t -124.43 111.79 16.16 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.424 1.09 . . . . 0.0 111.181 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -96.82 147.17 18.59 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 124.506 1.05 . . . . 0.0 113.402 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.5 t -152.87 168.69 24.92 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.111 1.365 . . . . 0.0 111.851 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.18 170.54 30.27 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.612 1.577 . . . . 0.0 113.514 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -99.86 82.03 0.53 Allowed Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.407 1.479 . . . . 0.0 112.548 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.8 t -140.89 170.14 16.31 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.92 1.288 . . . . 0.0 112.557 177.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -94.47 12.99 68.12 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.614 2.054 . . . . 0.0 115.549 -173.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 50.8 mt -59.67 135.72 23.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 125.936 1.694 . . . . 0.0 111.356 -174.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -144.64 19.6 1.67 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.811 1.645 . . . . 0.0 113.209 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.6 mt -67.23 -24.62 65.84 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.508 -1.37 . . . . 0.0 113.988 -174.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -72.78 170.08 15.38 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.256 1.822 . . . . 0.0 113.799 173.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.3 m -62.14 -33.78 75.12 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 121.007 -1.058 . . . . 0.0 112.312 174.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.7 t 48.5 72.04 0.31 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 127.71 2.404 . . . . 0.0 113.846 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -68.59 0.22 4.38 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.409 1.883 . . . . 0.0 115.582 -175.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.6 p -62.11 -36.11 80.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.681 1.592 . . . . 0.0 114.214 -179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -129.06 113.77 15.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.534 1.534 . . . . 0.0 111.038 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.03 0.35 60.1 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 125.007 1.289 . . . . 0.0 115.108 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.4 m -137.52 -172.15 3.15 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.391 1.476 . . . . 0.0 111.428 175.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -154.37 172.14 18.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.879 1.672 . . . . 0.0 110.611 -175.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -56.96 -35.94 69.72 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.748 2.019 . . . . 0.0 112.297 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -32.01 70.1 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.971 1.309 . . . . 0.0 112.448 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.8 p -92.22 -28.72 16.85 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.734 1.613 . . . . 0.0 113.859 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -52.73 -45.48 67.0 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.429 1.492 . . . . 0.0 112.55 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -55.61 -60.68 3.09 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.417 1.087 . . . . 0.0 110.812 175.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 34.1 mttp -58.01 -25.26 60.87 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmtp -68.49 -54.38 17.23 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.058 1.343 . . . . 0.0 113.687 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -141.7 14.91 2.14 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.81 1.782 . . . . 0.0 115.81 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.0 mt -126.33 146.09 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 O-C-N 120.771 -1.205 . . . . 0.0 110.066 175.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -142.56 151.92 42.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.392 0.677 . . . . 0.0 112.352 170.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -87.73 0.32 55.89 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.207 1.403 . . . . 0.0 112.206 170.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 t -159.44 107.17 1.76 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.421 1.888 . . . . 0.0 110.593 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -64.35 105.41 0.92 Allowed 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.734 -1.229 . . . . 0.0 110.973 175.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -112.25 1.77 16.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.347 1.459 . . . . 0.0 113.431 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.6 p -75.22 145.52 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.087 1.355 . . . . 0.0 112.572 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -132.34 8.42 4.3 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.172 1.789 . . . . 0.0 112.782 172.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 52.1 m 51.45 37.38 19.14 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.786 2.434 . . . . 0.0 114.011 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -148.28 -22.05 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.421 2.689 . . . . 0.0 112.896 176.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -106.65 -3.37 20.72 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.564 1.546 . . . . 0.0 113.398 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.2 pt -64.37 -8.94 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 113.571 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.6 ttt -56.67 -23.28 40.66 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.153 1.381 . . . . 0.0 113.123 164.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.8 t -99.86 -3.25 32.93 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.24 1.816 . . . . 0.0 114.076 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.6 p -107.42 -176.79 3.17 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.064 1.345 . . . . 0.0 111.373 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -64.37 -17.11 63.43 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.952 -1.092 . . . . 0.0 113.463 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -92.06 17.96 8.68 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.573 1.949 . . . . 0.0 113.849 -173.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -66.61 -8.01 24.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.707 2.003 . . . . 0.0 114.27 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -60.77 -2.47 0.55 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 128.252 2.621 . . . . 0.0 115.958 -175.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.9 t 49.09 53.73 12.11 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.182 1.793 . . . . 0.0 113.058 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 167.38 2.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.598 1.159 . . . . 0.0 112.303 170.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -76.49 -29.26 56.78 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.839 1.255 . . . . 0.0 112.764 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? -170.33 161.43 8.13 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.485 2.314 . . . . 0.0 110.642 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -147.08 143.45 28.33 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.599 0.76 . . . . 0.0 110.819 164.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 56.2 m -90.88 115.07 27.64 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.063 1.345 . . . . 0.0 109.197 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.94 128.34 43.8 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.481 1.037 . . . . 0.0 111.042 165.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.5 mt -99.97 112.87 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.662 1.585 . . . . 0.0 107.062 174.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -86.82 92.18 8.89 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.538 -0.726 . . . . 0.0 109.636 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 83.6 p -146.84 177.18 9.32 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.633 1.573 . . . . 0.0 112.728 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.31 160.04 46.27 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.385 1.474 . . . . 0.0 110.503 164.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -72.66 -22.08 21.15 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.584 2.189 . . . . 0.0 114.305 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.37 -55.78 41.85 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 124.902 1.281 . . . . 0.0 112.369 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.56 -0.93 7.45 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.371 2.714 . . . . 0.0 115.187 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.73 -53.89 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.718 1.607 . . . . 0.0 110.003 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -43.93 81.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.258 -0.902 . . . . 0.0 112.747 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.5 -3.49 37.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -172.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 56.6 mt -53.73 -35.78 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.627 0.771 . . . . 0.0 110.332 170.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.5 p -111.26 157.51 20.05 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.856 1.263 . . . . 0.0 113.304 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -154.5 110.62 3.23 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.571 1.948 . . . . 0.0 109.756 175.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.47 88.53 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.645 1.117 . . . . 0.0 114.873 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -77.47 116.82 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.681 1.192 . . . . 0.0 111.067 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.8 mt -111.61 -11.4 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.786 2.034 . . . . 0.0 110.769 173.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.2 5.89 4.03 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.617 2.367 . . . . 0.0 116.118 -170.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.3 t 52.71 64.93 1.67 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.568 1.547 . . . . 0.0 112.975 -173.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -157.33 152.57 26.11 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 126.053 1.741 . . . . 0.0 110.721 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -138.71 -172.03 3.21 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.909 -1.119 . . . . 0.0 111.645 164.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.8 t -124.37 141.22 45.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 125.59 1.556 . . . . 0.0 108.51 173.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.7 tp -49.63 140.93 10.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.505 1.122 . . . . 0.0 111.784 170.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.68 174.11 0.86 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 174.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 12.5 t -122.39 -20.92 5.95 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.114 1.366 . . . . 0.0 113.762 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.4 m -85.66 171.73 11.42 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.737 1.615 . . . . 0.0 111.902 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.32 109.53 16.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.446 1.099 . . . . 0.0 111.41 -178.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -105.12 160.19 15.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.926 1.69 . . . . 0.0 110.293 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -71.67 108.79 5.19 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.708 -0.62 . . . . 0.0 110.711 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -95.66 121.96 37.92 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.573 1.149 . . . . 0.0 111.574 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.4 t -121.92 88.66 2.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.269 1.828 . . . . 0.0 109.523 -175.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -88.14 158.62 18.49 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.384 -0.823 . . . . 0.0 111.166 173.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.2 m -145.74 141.23 27.81 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.041 0.936 . . . . 0.0 108.538 162.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -133.27 128.3 35.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.211 1.405 . . . . 0.0 110.008 -173.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.8 t -59.5 145.77 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-N 118.87 0.759 . . . . 0.0 112.54 -175.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.6 t -133.02 100.19 4.81 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.777 1.631 . . . . 0.0 111.011 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 C--O 1.253 1.284 0 C-N-CA 126.564 1.945 . . . . 0.0 111.519 -178.252 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.63 -58.73 0.07 OUTLIER 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.361 2.041 . . . . 0.0 111.862 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.8 m -139.67 171.82 13.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.597 2.359 . . . . 0.0 109.813 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -91.51 137.19 32.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.716 1.207 . . . . 0.0 110.451 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -137.44 165.05 27.19 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.401 . . . . 0.0 111.94 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mtpt -98.84 159.02 15.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 127.247 2.219 . . . . 0.0 112.08 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.64 110.43 21.75 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.276 1.83 . . . . 0.0 111.583 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -135.8 115.66 13.09 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.203 1.801 . . . . 0.0 111.322 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -122.16 150.34 42.37 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.376 1.07 . . . . 0.0 111.548 176.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -150.48 170.65 18.59 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.987 1.315 . . . . 0.0 111.788 173.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -140.81 104.33 4.68 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.866 0.866 . . . . 0.0 110.963 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.6 172.99 7.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.146 1.378 . . . . 0.0 112.767 -172.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.85 172.21 1.39 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.41 1.884 . . . . 0.0 113.941 168.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -139.22 155.63 47.66 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.42 1.888 . . . . 0.0 110.161 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.5 t -113.91 146.24 40.34 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.078 1.351 . . . . 0.0 111.769 174.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.6 m -148.95 -178.45 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 126.415 1.886 . . . . 0.0 111.744 -175.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -125.51 117.73 24.24 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.96 1.304 . . . . 0.0 111.715 175.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.74 130.99 34.95 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.083 0.953 . . . . 0.0 111.503 176.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -138.51 112.66 8.61 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.127 1.371 . . . . 0.0 108.978 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 57.92 57.81 3.94 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.914 1.286 . . . . 0.0 112.451 -172.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 63.97 26.95 14.26 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.407 2.283 . . . . 0.0 114.776 170.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -160.08 134.89 5.53 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.231 1.413 . . . . 0.0 109.744 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -75.85 109.1 2.83 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.667 2.911 . . . . 0.0 113.38 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.7 m -109.27 17.56 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.611 1.965 . . . . 0.0 112.722 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -152.68 139.18 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.576 -1.328 . . . . 0.0 110.656 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -84.49 147.88 26.83 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.954 0.502 . . . . 0.0 110.879 170.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.4 t -121.28 -54.49 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.404 0.682 . . . . 0.0 112.573 175.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.87 -173.66 43.51 Favored Glycine 0 CA--C 1.528 0.865 0 CA-C-N 119.247 0.931 . . . . 0.0 115.149 -171.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 t -129.19 118.48 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.892 1.677 . . . . 0.0 110.181 -172.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.43 4.76 25.76 Favored Glycine 0 CA--C 1.542 1.75 0 N-CA-C 115.663 1.025 . . . . 0.0 115.663 -174.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.2 p -165.82 166.0 17.98 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.625 2.37 . . . . 0.0 111.123 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.0 m -110.34 110.64 21.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.341 1.457 . . . . 0.0 110.526 172.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.92 160.99 53.76 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 123.459 0.552 . . . . 0.0 112.849 172.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.1 t -151.48 177.38 10.37 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.536 1.535 . . . . 0.0 111.647 177.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -170.64 175.06 44.57 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.296 1.426 . . . . 0.0 113.727 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -131.6 18.38 4.89 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 125.651 1.596 . . . . 0.0 115.051 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.3 m -123.88 156.84 35.52 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.842 1.657 . . . . 0.0 112.269 -175.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -81.67 49.13 4.0 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 125.53 1.538 . . . . 0.0 114.741 -173.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 49.8 mm -72.07 143.67 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.298 1.439 . . . . 0.0 111.295 -178.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -140.36 6.14 2.1 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.642 1.577 . . . . 0.0 114.278 -176.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -67.69 -22.43 65.28 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.063 1.345 . . . . 0.0 113.082 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -65.12 163.27 15.29 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.038 1.335 . . . . 0.0 112.983 169.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.4 m -66.33 -32.52 73.97 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 121.053 -1.029 . . . . 0.0 112.773 174.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.2 t 40.35 71.83 0.17 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 127.655 2.382 . . . . 0.0 113.965 -170.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.6 mp -59.57 -13.76 10.56 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 178.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.0 t -56.98 -31.87 65.5 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.992 1.717 . . . . 0.0 113.415 167.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -122.6 105.86 10.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.263 1.425 . . . . 0.0 111.406 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.62 2.91 64.9 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.926 1.251 . . . . 0.0 115.394 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.09 -168.99 2.39 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.472 1.509 . . . . 0.0 110.893 173.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 p30 -155.78 176.45 12.61 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.989 2.115 . . . . 0.0 110.627 -178.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -59.74 -35.17 74.02 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 0.0 112.943 173.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -48.11 83.04 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.501 1.12 . . . . 0.0 110.977 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.8 p -74.53 -31.18 62.05 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.42 1.488 . . . . 0.0 113.481 174.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -54.79 -41.14 70.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.055 1.342 . . . . 0.0 113.068 175.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -60.43 -61.71 2.4 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.514 0.725 . . . . 0.0 110.484 173.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.12 -21.35 59.15 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -65.13 -56.53 12.41 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.235 1.814 . . . . 0.0 113.017 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -147.45 22.81 1.16 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.529 1.678 . . . . 0.0 115.529 -172.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -126.6 147.73 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.368 1.467 . . . . 0.0 109.291 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -143.36 152.75 41.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -84.24 -1.52 55.35 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.869 1.668 . . . . 0.0 112.804 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.2 t -162.32 109.73 1.33 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.337 1.855 . . . . 0.0 110.971 176.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.4 ttp85 -67.17 106.5 2.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 120.459 -1.401 . . . . 0.0 110.556 172.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.35 3.05 13.3 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.129 1.372 . . . . 0.0 113.036 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 13.8 p -74.64 147.26 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.775 1.23 . . . . 0.0 113.168 -174.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -132.03 2.13 3.95 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.2 1.8 . . . . 0.0 113.266 174.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 93.8 m 45.66 54.31 7.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.447 2.299 . . . . 0.0 113.346 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -152.89 -29.88 0.14 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.372 2.669 . . . . 0.0 111.751 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -108.94 -4.06 17.04 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.77 1.628 . . . . 0.0 114.136 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.9 pt -61.98 -7.74 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.9 tpt -52.46 -27.8 17.59 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.277 1.431 . . . . 0.0 113.823 169.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 99.9 p -90.45 -5.14 56.44 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 p -100.43 -179.39 4.09 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.715 1.606 . . . . 0.0 111.695 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -68.92 -15.51 63.51 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.93 5.77 18.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.319 1.848 . . . . 0.0 114.849 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -63.14 -8.19 7.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.939 2.496 . . . . 0.0 115.207 -174.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -62.07 -5.68 2.4 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.446 1.898 . . . . 0.0 114.719 -173.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 43.5 t 47.18 45.88 16.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.923 1.689 . . . . 0.0 112.69 -170.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 157.33 21.82 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.876 1.27 . . . . 0.0 111.656 167.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -63.87 -34.22 77.45 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.659 1.184 . . . . 0.0 113.993 -171.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 9.7 ptmm? -163.04 158.9 22.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.069 1.748 . . . . 0.0 111.77 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -134.02 122.33 22.86 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.638 1.175 . . . . 0.0 110.105 173.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -88.16 92.73 9.26 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.149 0.579 . . . . 0.0 110.047 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -78.66 126.05 30.2 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.884 -0.51 . . . . 0.0 111.253 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -99.12 115.57 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.833 1.253 . . . . 0.0 108.091 171.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -88.68 87.37 7.23 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.904 -0.497 . . . . 0.0 110.005 167.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.8 t -151.39 171.07 18.07 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.267 1.027 . . . . 0.0 112.998 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.6 mtp-105 -74.64 163.62 67.01 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 126.376 1.871 . . . . 0.0 110.934 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.84 -24.08 25.13 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.24 1.96 . . . . 0.0 114.393 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.54 -57.12 27.08 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.92 1.288 . . . . 0.0 112.95 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.37 -1.06 8.36 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.194 2.596 . . . . 0.0 114.602 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -99.72 -54.62 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 126.291 1.836 . . . . 0.0 109.665 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -44.96 77.61 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.41 -0.806 . . . . 0.0 112.843 -178.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.76 -4.11 38.64 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -172.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.4 mt -53.72 -35.56 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.702 0.801 . . . . 0.0 110.654 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.69 157.84 19.29 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.842 1.257 . . . . 0.0 113.196 172.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -155.45 109.26 2.83 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.985 1.714 . . . . 0.0 110.373 177.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.05 2.41 88.25 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.57 1.081 . . . . 0.0 114.909 -178.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.9 mt -76.23 118.92 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.752 1.221 . . . . 0.0 111.223 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -113.27 -9.7 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 126.887 2.075 . . . . 0.0 110.863 173.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.4 7.72 3.34 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.517 2.327 . . . . 0.0 116.01 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 79.4 p 50.24 61.8 3.01 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.711 1.605 . . . . 0.0 113.909 -173.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -156.14 155.99 33.47 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.576 1.551 . . . . 0.0 110.952 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -138.65 -171.81 3.15 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.959 -1.088 . . . . 0.0 111.106 166.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.4 t -124.87 142.34 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.294 1.437 . . . . 0.0 108.583 173.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.1 tp -47.97 137.4 10.19 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.241 1.016 . . . . 0.0 111.99 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.88 171.95 1.93 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.618 0.767 . . . . 0.0 112.293 175.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.6 t -118.27 -25.61 6.54 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.401 1.081 . . . . 0.0 113.835 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.1 m -82.4 169.81 16.01 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.655 1.182 . . . . 0.0 111.989 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -116.76 103.56 10.47 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.281 1.032 . . . . 0.0 111.4 -175.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -98.33 162.12 13.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.75 1.62 . . . . 0.0 110.96 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.64 105.81 4.41 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.918 -0.489 . . . . 0.0 110.122 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -97.93 124.62 42.45 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.615 1.166 . . . . 0.0 111.642 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.1 t -125.62 95.08 4.32 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 125.647 1.579 . . . . 0.0 110.05 -172.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.97 138.65 31.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.961 1.304 . . . . 0.0 110.506 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 43.3 m -113.32 151.4 31.24 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.95 -1.094 . . . . 0.0 108.481 161.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -135.57 123.65 22.91 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.811 0.844 . . . . 0.0 109.391 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.1 t -57.05 146.23 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.648 0.779 . . . . 0.0 111.483 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -135.65 103.63 5.5 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.235 1.014 . . . . 0.0 111.666 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.253 1.285 0 C-N-CA 126.693 1.997 . . . . 0.0 111.426 179.671 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.2 -48.52 0.35 Allowed 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.105 1.87 . . . . 0.0 113.305 -165.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.4 m -136.92 -167.89 2.17 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.692 2.397 . . . . 0.0 109.352 175.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.12 146.97 43.76 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.565 1.146 . . . . 0.0 109.327 168.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -141.51 161.31 38.22 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.456 1.502 . . . . 0.0 110.423 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -105.42 158.04 16.93 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.031 1.332 . . . . 0.0 113.766 177.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.72 110.9 18.17 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.701 2.0 . . . . 0.0 111.466 -171.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -134.98 98.43 4.01 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.086 1.354 . . . . 0.0 112.234 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -116.5 137.27 52.3 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.398 1.479 . . . . 0.0 111.171 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 72.9 m -145.94 167.44 23.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.141 1.776 . . . . 0.0 111.027 -175.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 m -140.3 104.53 4.81 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.289 -0.882 . . . . 0.0 111.24 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.86 171.82 5.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.937 1.295 . . . . 0.0 113.252 -170.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.98 172.73 1.62 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 128.788 2.835 . . . . 0.0 113.658 168.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -143.46 145.33 32.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.569 1.948 . . . . 0.0 111.643 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.3 t -105.36 139.33 40.16 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.023 0.929 . . . . 0.0 111.277 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.9 m -146.88 -178.93 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.306 1.842 . . . . 0.0 111.335 -173.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.2 m -127.03 116.02 20.09 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.688 1.195 . . . . 0.0 111.552 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -85.45 131.57 34.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.345 0.658 . . . . 0.0 111.616 173.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.84 115.45 10.62 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.22 1.408 . . . . 0.0 108.55 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 58.6 54.98 5.05 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.958 1.303 . . . . 0.0 112.335 -170.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 65.03 25.54 12.63 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.493 2.317 . . . . 0.0 115.077 169.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.6 133.08 5.73 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.962 1.305 . . . . 0.0 109.653 -175.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -75.91 108.55 2.71 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.803 3.002 . . . . 0.0 112.984 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.8 m -111.01 15.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 126.169 1.788 . . . . 0.0 113.044 -178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.4 143.67 24.07 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.139 1.336 . . . . 0.0 111.086 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -102.39 126.78 49.52 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.677 1.191 . . . . 0.0 111.407 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.6 t -101.68 -56.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.903 0.881 . . . . 0.0 111.852 -178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.27 -171.78 41.15 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 -170.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 t -131.26 120.39 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.005 1.722 . . . . 0.0 110.168 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.27 2.29 25.34 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.579 0.992 . . . . 0.0 115.579 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.4 p -170.28 166.86 8.68 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.895 2.478 . . . . 0.0 111.079 -176.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.8 m -107.47 110.56 22.53 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.539 1.536 . . . . 0.0 110.996 173.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.11 78.2 1.69 Allowed Glycine 0 CA--C 1.534 1.223 0 C-N-CA 125.332 1.444 . . . . 0.0 113.245 -177.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 6.6 t -82.21 174.58 11.05 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.617 1.167 . . . . 0.0 113.197 177.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 177.76 -179.27 48.37 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 126.303 1.906 . . . . 0.0 113.38 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -134.13 60.03 0.66 Allowed Glycine 0 CA--C 1.533 1.185 0 C-N-CA 125.544 1.545 . . . . 0.0 113.378 -175.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.8 m -137.19 161.45 36.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.694 1.597 . . . . 0.0 112.107 -178.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.38 25.69 3.2 Favored Glycine 0 CA--C 1.539 1.531 0 C-N-CA 125.916 1.722 . . . . 0.0 115.684 -175.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 68.4 mt -65.5 139.51 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 125.83 1.652 . . . . 0.0 110.815 -175.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -150.81 8.95 0.58 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.156 1.383 . . . . 0.0 113.629 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 pp -62.71 -27.96 69.62 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.378 1.471 . . . . 0.0 114.747 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -59.6 162.81 4.72 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.884 2.074 . . . . 0.0 113.481 171.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.1 m -58.8 -31.04 68.07 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 121.079 -1.013 . . . . 0.0 112.799 178.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.4 t 47.82 59.36 4.24 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.93 2.092 . . . . 0.0 113.303 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.7 mp -59.78 -14.18 13.54 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -173.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.8 p -62.14 -28.47 69.67 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.568 1.547 . . . . 0.0 114.143 171.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.55 104.61 8.81 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.535 1.534 . . . . 0.0 111.627 175.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 103.19 -2.5 47.28 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.449 1.5 . . . . 0.0 115.255 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.1 m -136.4 -166.07 1.83 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.016 1.326 . . . . 0.0 111.435 175.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -153.22 170.61 20.14 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.752 2.021 . . . . 0.0 109.279 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.0 t-105 -54.19 -36.97 63.99 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.585 1.554 . . . . 0.0 112.293 166.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -44.41 92.02 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.901 0.881 . . . . 0.0 111.491 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.6 p -84.97 -26.05 27.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.297 1.039 . . . . 0.0 113.771 176.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -52.47 -42.3 64.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.785 1.634 . . . . 0.0 112.996 173.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -57.62 -62.54 1.72 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.056 0.942 . . . . 0.0 110.475 172.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.22 -22.13 50.73 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -67.65 -55.23 14.09 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.186 1.795 . . . . 0.0 112.44 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -146.52 22.27 1.31 Allowed 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -173.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -126.78 147.84 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 O-C-N 120.473 -1.392 . . . . 0.0 109.006 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.8 t -143.05 152.08 41.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -83.27 -1.5 53.32 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.838 1.655 . . . . 0.0 112.779 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.9 t -163.26 107.48 1.05 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.204 1.802 . . . . 0.0 111.429 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -67.92 110.54 3.91 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.376 -1.453 . . . . 0.0 110.42 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -129.33 7.71 5.42 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.603 1.561 . . . . 0.0 113.088 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.5 t -75.68 141.35 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.804 1.241 . . . . 0.0 111.983 -172.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -126.3 4.99 7.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.075 1.75 . . . . 0.0 113.437 -178.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.0 m 55.07 40.12 31.8 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 126.957 2.103 . . . . 0.0 114.26 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -152.16 -26.23 0.18 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.084 2.154 . . . . 0.0 113.432 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -99.61 -5.24 29.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.63 1.172 . . . . 0.0 113.482 176.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -64.53 -5.07 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.939 1.296 . . . . 0.0 114.435 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -53.5 -25.93 18.66 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 160.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.3 t -97.54 -15.84 20.35 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.708 1.603 . . . . 0.0 113.844 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 49.3 p -94.75 -179.81 4.99 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.014 1.326 . . . . 0.0 110.94 175.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -68.43 -11.19 59.35 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -85.52 12.54 8.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.548 2.339 . . . . 0.0 114.811 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 36.5 p90 -67.21 -8.77 34.06 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.061 2.144 . . . . 0.0 114.76 -171.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -62.59 -6.64 3.67 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.445 2.298 . . . . 0.0 115.384 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.0 t 40.55 56.02 2.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.513 1.925 . . . . 0.0 112.949 -165.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 158.87 28.17 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.223 1.409 . . . . 0.0 111.61 167.344 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.82 -35.48 80.8 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -172.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -160.4 156.53 26.27 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.097 1.759 . . . . 0.0 111.564 170.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -131.34 129.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.775 1.23 . . . . 0.0 109.61 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.0 m -96.83 93.84 6.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.691 0.796 . . . . 0.0 109.68 177.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -77.89 127.86 33.04 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.529 0.732 . . . . 0.0 111.394 175.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.6 mt -105.77 114.2 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.985 1.714 . . . . 0.0 107.901 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -86.35 84.2 7.51 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.822 -0.549 . . . . 0.0 110.479 170.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.8 m -141.88 158.29 43.97 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.611 1.565 . . . . 0.0 112.665 178.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -72.41 161.48 78.86 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.898 1.279 . . . . 0.0 110.762 164.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.8 -21.58 28.47 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.401 2.067 . . . . 0.0 114.375 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -61.5 -58.11 20.7 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 119.551 1.069 . . . . 0.0 112.572 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.37 0.41 5.39 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.148 2.565 . . . . 0.0 115.039 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -103.61 -54.96 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.336 1.854 . . . . 0.0 109.747 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -44.47 78.88 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.112 -0.993 . . . . 0.0 112.884 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.11 32.98 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.509 1.299 . . . . 0.0 114.509 -173.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.2 mt -52.61 -35.95 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.622 0.769 . . . . 0.0 110.645 169.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.8 p -109.8 159.99 16.72 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.286 1.034 . . . . 0.0 113.277 174.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 tptp -155.11 107.2 2.68 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.694 1.598 . . . . 0.0 110.567 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 6.29 88.67 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.275 0.941 . . . . 0.0 114.898 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.1 mt -76.56 115.39 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.518 1.159 . . . . 0.0 110.952 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 mt -112.33 -10.59 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 126.833 2.053 . . . . 0.0 110.893 173.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.96 3.79 6.32 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.406 2.282 . . . . 0.0 115.72 -173.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.1 t 53.44 66.2 1.3 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.819 1.647 . . . . 0.0 113.013 -173.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -156.46 160.53 39.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.281 1.832 . . . . 0.0 111.298 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -142.31 -169.73 3.02 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.693 -1.254 . . . . 0.0 111.733 164.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.5 t -125.08 139.68 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.652 1.581 . . . . 0.0 108.783 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.9 tp -49.53 139.71 11.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.743 1.217 . . . . 0.0 111.836 170.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.1 172.28 1.47 Allowed 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 174.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.1 t -122.49 -30.36 3.94 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.93 1.292 . . . . 0.0 113.802 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.5 m -75.63 169.89 17.23 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.546 1.138 . . . . 0.0 111.648 171.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -123.7 105.03 9.36 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.991 0.916 . . . . 0.0 111.524 -173.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -100.28 163.76 12.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.622 1.969 . . . . 0.0 110.835 -171.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -73.86 104.16 4.64 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.724 -0.61 . . . . 0.0 110.411 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.07 131.0 44.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.089 1.355 . . . . 0.0 111.892 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.6 t -135.84 96.8 3.49 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.156 1.382 . . . . 0.0 110.801 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -93.6 155.03 17.52 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.706 0.765 . . . . 0.0 111.77 171.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.08 99.24 3.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.594 0.757 . . . . 0.0 110.979 171.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -86.59 133.05 33.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.74 1.216 . . . . 0.0 111.2 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.98 147.79 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 C-N-CA 125.075 1.35 . . . . 0.0 111.933 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 76.5 p -120.89 96.21 5.02 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.065 1.346 . . . . 0.0 111.536 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.456 1.502 . . . . 0.0 112.762 176.479 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 61.8 mtt85 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 118.964 -0.541 . . . . 0.0 109.95 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -72.66 -52.05 0.17 Allowed 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 121.863 1.708 . . . . 0.0 112.881 -169.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.0 m -141.63 168.33 20.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.157 2.183 . . . . 0.0 110.064 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -87.97 137.55 32.23 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.767 1.227 . . . . 0.0 109.997 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -137.17 160.86 37.77 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.694 1.198 . . . . 0.0 112.29 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -96.15 155.31 16.81 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.635 2.374 . . . . 0.0 111.447 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tp -80.34 127.89 32.92 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.674 1.19 . . . . 0.0 111.352 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -147.33 96.86 2.77 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.335 1.454 . . . . 0.0 112.006 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 mmtm -100.55 149.12 24.05 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.193 1.397 . . . . 0.0 111.208 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 29.6 m -155.89 169.0 25.44 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.203 1.801 . . . . 0.0 111.152 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 m -141.17 105.27 4.79 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.293 -0.88 . . . . 0.0 110.867 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.28 172.09 6.39 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.778 1.231 . . . . 0.0 113.652 -171.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.78 174.24 0.63 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 128.241 2.616 . . . . 0.0 114.515 168.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.79 143.77 31.5 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.878 2.071 . . . . 0.0 111.702 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 t -102.99 140.23 37.52 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.569 1.148 . . . . 0.0 111.095 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -147.18 -179.94 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 125.926 1.69 . . . . 0.0 111.711 -175.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 m -125.56 117.78 24.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.828 1.251 . . . . 0.0 111.583 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.81 131.52 34.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.625 0.77 . . . . 0.0 111.517 173.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -135.21 115.93 13.89 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.69 1.596 . . . . 0.0 108.437 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 56.47 55.82 6.2 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.688 1.195 . . . . 0.0 112.416 -171.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.59 24.83 11.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.551 2.34 . . . . 0.0 114.936 169.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -155.54 131.26 5.51 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.485 1.114 . . . . 0.0 109.567 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -76.29 102.32 1.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.975 3.116 . . . . 0.0 112.046 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 14.7 m -90.44 -10.21 10.23 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.583 0 CA-C-O 117.728 -1.129 . . . . 0.0 112.494 -179.038 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -138.58 133.3 32.33 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.657 1.571 . . . . 0.0 111.041 -163.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -82.93 144.81 29.77 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.288 0.495 . . . . 0.0 110.168 171.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -116.31 -51.78 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.831 0.853 . . . . 0.0 111.652 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.81 -177.23 47.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 123.564 0.602 . . . . 0.0 113.018 -176.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -124.56 133.3 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.522 1.129 . . . . 0.0 111.494 -174.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.7 -6.58 6.11 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.551 1.072 . . . . 0.0 115.616 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -173.6 169.04 4.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.538 3.135 . . . . 0.0 109.201 -168.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.6 m -103.61 132.18 50.09 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.592 1.557 . . . . 0.0 110.683 173.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.5 84.93 0.74 Allowed Glycine 0 CA--C 1.532 1.142 0 C-N-CA 126.049 1.785 . . . . 0.0 113.056 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.4 t -61.84 164.23 6.6 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.976 1.31 . . . . 0.0 113.01 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 77.19 -42.89 1.94 Allowed Glycine 0 CA--C 1.538 1.523 0 C-N-CA 126.128 1.823 . . . . 0.0 114.859 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.28 88.44 1.99 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.759 1.647 . . . . 0.0 112.695 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.8 m -56.71 134.9 55.16 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.527 1.531 . . . . 0.0 112.962 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -77.84 35.96 1.65 Allowed Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.038 1.78 . . . . 0.0 115.707 -174.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 66.2 mt -69.29 140.39 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 125.783 1.633 . . . . 0.0 109.969 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -135.58 -2.41 2.44 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.341 1.456 . . . . 0.0 114.246 -177.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.85 -21.02 63.39 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.233 1.413 . . . . 0.0 112.78 -177.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -139.69 161.51 37.37 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.676 1.991 . . . . 0.0 111.798 173.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.9 m -74.17 -19.99 60.36 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.783 1.233 . . . . 0.0 111.957 168.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.4 t 54.5 30.4 12.9 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.399 1.88 . . . . 0.0 113.713 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.2 mp 55.13 75.31 0.32 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.499 2.32 . . . . 0.0 112.336 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.9 t -116.62 -39.2 3.35 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.108 1.763 . . . . 0.0 113.714 -176.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.87 134.94 37.41 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.486 1.514 . . . . 0.0 111.072 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 66.93 11.86 58.93 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 124.583 1.087 . . . . 0.0 115.586 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 39.6 p -104.58 -179.67 4.01 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.495 1.918 . . . . 0.0 111.832 -178.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -153.76 156.53 37.91 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 122.554 1.169 . . . . 0.0 111.889 176.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.6 t-105 -50.27 -37.25 35.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.044 1.738 . . . . 0.0 111.813 162.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -27.21 64.48 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.471 1.508 . . . . 0.0 113.019 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.2 p -106.78 -20.5 13.32 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.837 1.655 . . . . 0.0 113.942 174.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -51.3 -40.97 60.14 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.136 1.774 . . . . 0.0 112.557 171.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -58.13 -65.21 0.68 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.779 1.232 . . . . 0.0 110.519 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.01 -21.76 63.9 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -177.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -63.14 -48.04 80.17 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.1 1.76 . . . . 0.0 113.674 174.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -154.39 21.25 0.48 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 115.759 1.762 . . . . 0.0 115.759 -175.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.5 mt -128.47 147.3 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.354 1.461 . . . . 0.0 109.386 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -144.71 154.48 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 176.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -86.63 0.44 54.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.076 1.75 . . . . 0.0 112.591 167.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.67 109.88 1.27 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.443 1.897 . . . . 0.0 111.279 176.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 ttp85 -66.96 104.49 1.39 Allowed 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.473 -1.392 . . . . 0.0 110.304 171.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -114.79 5.7 15.31 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.833 1.653 . . . . 0.0 112.677 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 85.7 t -81.73 139.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.241 1.016 . . . . 0.0 111.454 -173.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -126.37 8.07 7.11 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.201 1.8 . . . . 0.0 112.539 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 28.3 m 53.33 40.9 32.0 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.27 2.228 . . . . 0.0 113.487 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -153.16 -26.44 0.15 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 127.818 2.447 . . . . 0.0 112.851 178.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -99.43 -5.11 30.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.746 1.218 . . . . 0.0 113.808 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -63.98 -8.24 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.837 1.255 . . . . 0.0 114.136 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.2 tmm? -55.71 -31.01 62.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.152 0.981 . . . . 0.0 112.677 163.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.5 m -88.98 -9.16 52.44 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.572 1.549 . . . . 0.0 114.671 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.4 p -106.14 179.15 4.35 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.261 1.425 . . . . 0.0 111.218 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -65.61 -15.59 62.89 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.551 -1.343 . . . . 0.0 114.097 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.9 7.52 8.7 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 127.42 2.288 . . . . 0.0 114.694 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -63.79 -8.06 9.62 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.126 2.171 . . . . 0.0 115.093 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 58.7 t60 -61.29 -10.74 7.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.217 1.807 . . . . 0.0 114.796 -174.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.1 t 39.55 62.45 1.18 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.968 2.107 . . . . 0.0 113.249 -165.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 159.97 32.02 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.741 161.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.54 -31.32 72.32 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.36 1.464 . . . . 0.0 114.625 -171.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.6 ptmm? -160.4 156.49 26.22 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.576 1.55 . . . . 0.0 111.541 168.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -128.22 149.28 50.53 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.857 0.863 . . . . 0.0 110.231 168.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.9 m -115.33 91.8 3.72 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.049 0.94 . . . . 0.0 109.769 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -80.25 128.12 33.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.278 0.561 . . . . 0.0 111.266 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 82.6 mt -105.93 113.69 43.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.001 1.721 . . . . 0.0 107.432 176.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -84.24 89.08 7.27 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.676 -0.64 . . . . 0.0 110.022 168.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 64.3 p -149.07 164.49 34.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.511 1.124 . . . . 0.0 112.811 171.446 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -76.45 161.77 73.39 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.701 1.2 . . . . 0.0 110.611 171.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -68.99 -21.35 37.2 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.028 1.819 . . . . 0.0 114.563 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.95 -57.38 21.67 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 119.483 1.038 . . . . 0.0 113.015 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.2 -0.46 5.69 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.446 2.764 . . . . 0.0 115.157 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -101.41 -56.42 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 109.577 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.04 -43.76 86.62 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.229 -0.919 . . . . 0.0 113.031 -179.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.93 -3.28 34.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 64.5 mt -53.5 -35.8 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.529 0.732 . . . . 0.0 110.615 170.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.0 p -109.02 159.26 16.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.284 1.034 . . . . 0.0 113.262 174.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -153.91 102.07 2.48 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.845 1.658 . . . . 0.0 110.577 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.85 5.47 87.91 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.175 0.893 . . . . 0.0 114.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.8 mt -73.82 115.68 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-N 118.635 1.217 . . . . 0.0 111.177 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -109.42 -12.1 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 126.614 1.966 . . . . 0.0 110.809 171.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.15 5.68 4.18 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.477 2.311 . . . . 0.0 116.217 -170.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.0 t 52.38 64.87 1.69 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.446 1.498 . . . . 0.0 112.741 -173.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -156.13 158.05 37.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 126.279 1.832 . . . . 0.0 111.058 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -144.34 -169.59 3.17 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.747 -1.22 . . . . 0.0 111.839 163.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.84 141.37 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 125.681 1.592 . . . . 0.0 108.735 171.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.2 tp -50.73 141.6 12.69 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.682 1.193 . . . . 0.0 111.889 170.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.58 171.49 1.98 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 173.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -122.4 -20.46 6.09 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.804 1.242 . . . . 0.0 114.017 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 41.1 m -83.96 170.37 14.06 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.07 1.348 . . . . 0.0 111.63 174.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -117.57 106.02 12.68 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.576 1.151 . . . . 0.0 111.023 -178.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -98.93 159.2 15.12 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.714 1.606 . . . . 0.0 110.341 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -70.52 106.94 3.63 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.944 -0.472 . . . . 0.0 110.232 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.48 132.31 44.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.952 1.301 . . . . 0.0 111.789 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.4 t -136.11 93.57 2.93 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.746 1.219 . . . . 0.0 109.87 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.8 159.28 17.82 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.733 0.813 . . . . 0.0 110.488 171.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.07 139.79 29.13 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.257 1.023 . . . . 0.0 109.371 161.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -124.13 125.94 45.34 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.545 1.138 . . . . 0.0 110.573 -174.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.07 145.34 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.561 0.744 . . . . 0.0 111.634 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.2 t -135.9 105.69 6.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.471 1.108 . . . . 0.0 111.453 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.6 t . . . . . 0 C--O 1.254 1.33 0 C-N-CA 126.539 1.936 . . . . 0.0 111.56 -179.402 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 119.296 -0.383 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -81.13 -46.4 0.08 OUTLIER 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 121.994 1.796 . . . . 0.0 114.126 -164.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 m -135.18 165.97 24.18 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.804 2.042 . . . . 0.0 109.817 171.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.6 mmpt? -95.34 142.74 27.37 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.942 0.897 . . . . 0.0 110.983 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -136.91 156.14 48.85 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.509 1.524 . . . . 0.0 110.995 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.97 151.64 19.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.17 1.388 . . . . 0.0 112.302 172.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.6 110.31 16.85 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.743 2.017 . . . . 0.0 111.372 -174.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -130.36 116.97 19.04 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.544 1.537 . . . . 0.0 111.466 175.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -130.35 150.43 51.59 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.968 1.707 . . . . 0.0 110.835 174.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.8 m -156.69 173.9 16.27 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.198 1.799 . . . . 0.0 111.43 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -144.27 101.49 3.71 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.067 -1.021 . . . . 0.0 110.861 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.13 175.8 8.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.192 1.397 . . . . 0.0 113.108 -176.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.21 170.02 5.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.162 2.585 . . . . 0.0 113.276 172.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -140.37 143.76 35.89 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.736 1.614 . . . . 0.0 111.811 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.7 t -102.21 143.99 31.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.916 0.865 . . . . 0.0 111.232 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -147.5 -178.05 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.455 1.902 . . . . 0.0 111.597 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.3 m -126.91 115.4 19.22 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.768 1.227 . . . . 0.0 111.612 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.9 t -83.29 129.87 35.03 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.113 0.965 . . . . 0.0 111.497 176.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.11 113.0 8.13 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.51 1.124 . . . . 0.0 108.538 177.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.7 59.46 3.22 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.522 1.529 . . . . 0.0 113.025 -169.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 62.84 26.46 15.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.599 2.359 . . . . 0.0 114.8 169.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.43 134.7 5.8 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 125.317 1.447 . . . . 0.0 109.559 -176.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.41 107.97 2.6 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.644 2.896 . . . . 0.0 113.072 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.9 m -108.31 17.58 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.777 2.031 . . . . 0.0 112.603 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -153.27 140.53 19.52 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.137 1.335 . . . . 0.0 110.589 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -86.07 148.2 25.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.928 0.491 . . . . 0.0 110.387 170.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.4 t -119.0 -58.8 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 123.675 0.79 . . . . 0.0 111.771 173.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.86 -172.3 42.18 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-N 118.537 0.608 . . . . 0.0 114.089 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.2 t -128.77 123.99 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.179 1.392 . . . . 0.0 109.891 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.3 3.49 25.2 Favored Glycine 0 CA--C 1.541 1.713 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -175.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 99.0 p -165.87 164.89 18.55 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.15 2.18 . . . . 0.0 111.42 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 93.1 m -112.72 108.64 17.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.631 1.572 . . . . 0.0 110.611 171.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -90.12 164.36 30.96 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 123.971 0.796 . . . . 0.0 112.617 171.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.1 t -154.18 179.93 8.5 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.959 1.304 . . . . 0.0 111.721 174.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -151.69 172.22 31.12 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.624 1.583 . . . . 0.0 113.475 177.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -129.96 21.04 5.01 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 125.828 1.68 . . . . 0.0 114.808 -175.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.5 m -125.35 164.85 19.49 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.97 1.708 . . . . 0.0 112.423 -173.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.2 21.99 2.12 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 126.017 1.77 . . . . 0.0 115.864 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 90.7 mt -65.0 147.69 12.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 126.59 1.956 . . . . 0.0 110.52 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -140.62 14.53 2.34 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 125.081 1.352 . . . . 0.0 113.346 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.56 -15.35 63.51 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -176.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.68 169.87 3.7 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.212 1.005 . . . . 0.0 113.388 169.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 36.3 m -70.17 -20.54 63.12 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.917 -1.115 . . . . 0.0 113.147 176.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.3 p 46.1 43.07 10.51 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.115 2.166 . . . . 0.0 115.007 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mp -55.03 -20.8 10.22 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.62 1.568 . . . . 0.0 114.299 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.0 p -55.34 -33.15 63.11 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.333 1.853 . . . . 0.0 114.692 173.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.09 104.1 8.67 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.624 1.57 . . . . 0.0 111.362 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.21 -0.19 50.8 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.441 1.496 . . . . 0.0 115.193 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -137.09 -165.87 1.82 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.284 1.433 . . . . 0.0 111.032 173.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -155.12 171.94 18.96 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.903 1.681 . . . . 0.0 109.558 -178.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.2 t-105 -55.07 -36.64 65.83 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.142 1.777 . . . . 0.0 112.185 169.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.88 -37.34 76.35 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.866 1.266 . . . . 0.0 112.195 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 p -89.47 -27.91 20.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.542 1.137 . . . . 0.0 113.521 174.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -52.05 -44.4 64.25 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.787 1.635 . . . . 0.0 113.067 174.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -56.02 -63.06 1.3 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -60.36 -20.01 57.83 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -70.11 -46.87 63.9 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.123 1.369 . . . . 0.0 113.311 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -153.04 23.65 0.56 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -176.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.4 mt -128.62 147.8 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 120.147 -1.596 . . . . 0.0 109.299 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -147.78 155.68 41.94 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 177.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.07 2.31 54.27 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.255 1.822 . . . . 0.0 112.814 167.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.1 t -160.18 114.41 2.22 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.185 1.794 . . . . 0.0 111.23 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.9 ttp-105 -66.47 103.21 1.0 Allowed 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.669 -1.27 . . . . 0.0 110.45 172.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -112.83 2.89 16.12 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.059 1.344 . . . . 0.0 113.45 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.2 p -75.54 145.06 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.355 1.062 . . . . 0.0 112.398 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -130.32 8.08 5.03 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.112 1.765 . . . . 0.0 112.703 172.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 21.4 m 48.37 50.85 16.04 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.895 2.478 . . . . 0.0 113.238 -176.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.43 -17.01 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.366 2.266 . . . . 0.0 113.202 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -110.26 -2.99 16.49 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.936 1.695 . . . . 0.0 113.767 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -63.98 -8.66 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.637 1.575 . . . . 0.0 113.913 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 ppp? -53.01 -22.51 5.83 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.8 t -98.07 -21.26 16.88 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.487 1.515 . . . . 0.0 113.995 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.1 p -87.35 -177.7 6.01 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 111.849 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -63.22 -20.53 65.51 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.832 -1.168 . . . . 0.0 113.646 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.79 21.81 3.39 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.569 1.948 . . . . 0.0 113.326 -175.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -63.6 -7.03 6.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 126.092 1.757 . . . . 0.0 114.663 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 66.0 t60 -64.7 -6.46 7.92 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.583 1.553 . . . . 0.0 114.653 -177.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.31 33.6 18.72 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.187 1.795 . . . . 0.0 114.476 -177.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 158.18 3.52 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.061 1.745 . . . . 0.0 113.926 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.04 -35.69 81.07 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.435 1.494 . . . . 0.0 114.877 -173.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -161.18 163.44 31.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.185 1.394 . . . . 0.0 112.774 165.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -131.63 166.18 22.02 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.979 0.912 . . . . 0.0 111.336 166.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.0 m -126.73 93.84 3.89 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.734 1.214 . . . . 0.0 109.404 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -77.95 122.64 25.78 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.259 0.624 . . . . 0.0 110.759 174.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -98.64 114.52 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.954 1.302 . . . . 0.0 107.848 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -87.02 86.1 7.29 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.386 0.612 . . . . 0.0 110.122 167.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.5 p -145.87 166.66 25.31 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.897 1.279 . . . . 0.0 112.205 168.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -73.29 164.47 60.73 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.406 1.082 . . . . 0.0 111.325 168.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.91 -23.19 25.83 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.747 2.298 . . . . 0.0 114.521 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -59.57 -58.49 19.09 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.61 1.164 . . . . 0.0 112.806 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.56 0.73 5.08 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.307 2.671 . . . . 0.0 114.926 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.6 t -103.3 -55.57 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 126.604 1.962 . . . . 0.0 109.82 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -43.07 85.11 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.208 -0.933 . . . . 0.0 112.769 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.64 -5.58 46.18 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -173.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.5 mt -53.49 -36.01 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.598 0.759 . . . . 0.0 110.58 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 p -111.5 158.44 19.16 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.805 1.242 . . . . 0.0 113.057 173.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -155.77 105.97 2.44 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.742 1.617 . . . . 0.0 110.579 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.35 5.62 86.94 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 123.984 0.802 . . . . 0.0 114.733 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.4 mt -77.45 116.53 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.676 1.19 . . . . 0.0 110.87 -178.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 7.5 mt -111.33 -12.52 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 126.768 2.027 . . . . 0.0 110.879 175.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.32 7.67 2.68 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 127.633 2.373 . . . . 0.0 116.095 -170.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.9 t 49.69 66.11 1.22 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.996 1.318 . . . . 0.0 113.276 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.1 tttt -159.37 157.46 30.39 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.352 1.461 . . . . 0.0 111.356 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -145.01 -169.11 3.11 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.576 -1.327 . . . . 0.0 112.067 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 16.8 t -125.74 143.2 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 126.127 1.771 . . . . 0.0 108.865 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.5 tp -50.78 141.91 12.32 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.559 1.143 . . . . 0.0 111.982 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.94 172.9 1.53 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 8.8 t -120.37 -28.85 4.93 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.799 1.24 . . . . 0.0 113.573 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.9 m -76.96 171.7 14.37 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.419 1.488 . . . . 0.0 111.845 173.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -123.04 110.4 15.29 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.118 0.967 . . . . 0.0 111.144 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -105.98 159.67 15.87 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.157 1.783 . . . . 0.0 110.245 -171.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.64 109.54 4.38 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.337 0.589 . . . . 0.0 110.513 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.03 123.18 44.81 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.283 1.433 . . . . 0.0 111.231 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.9 t -126.71 93.61 3.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.436 1.494 . . . . 0.0 110.686 -173.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.02 163.45 16.28 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.463 0.649 . . . . 0.0 110.329 173.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.96 138.77 19.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 158.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -126.74 134.6 50.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.931 1.292 . . . . 0.0 109.271 -175.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 29.2 t -60.9 149.93 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 123.556 0.742 . . . . 0.0 111.816 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -134.52 106.64 7.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.22 1.408 . . . . 0.0 110.933 171.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.253 1.262 0 C-N-CA 126.244 1.818 . . . . 0.0 112.602 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.0 ptt180 . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.95 -50.04 0.22 Allowed 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 121.612 1.541 . . . . 0.0 111.521 172.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -145.84 179.28 7.57 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.61 2.364 . . . . 0.0 109.574 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -110.16 131.16 55.31 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.644 1.178 . . . . 0.0 110.733 -177.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.84 161.94 33.79 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.222 1.409 . . . . 0.0 111.924 -176.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -107.55 151.13 26.01 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.002 1.721 . . . . 0.0 112.764 177.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.74 113.36 16.75 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.555 1.942 . . . . 0.0 111.487 -172.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -139.55 109.45 6.36 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.39 1.476 . . . . 0.0 111.883 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -118.12 153.81 33.17 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.417 1.487 . . . . 0.0 111.637 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.0 m -156.21 172.19 18.89 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.17 1.788 . . . . 0.0 111.557 175.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 m -141.26 104.91 4.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.869 0.868 . . . . 0.0 110.569 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.42 172.43 7.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.682 1.193 . . . . 0.0 113.664 -170.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.79 174.28 0.85 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.271 2.628 . . . . 0.0 114.397 167.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.01 147.06 32.21 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.682 1.993 . . . . 0.0 111.726 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 t -108.37 134.94 50.48 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.869 1.268 . . . . 0.0 111.404 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.3 m -141.79 -178.68 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.935 1.694 . . . . 0.0 111.707 -173.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 2.1 m -129.86 115.04 16.66 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.457 -0.777 . . . . 0.0 111.785 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.3 t -83.0 128.54 34.57 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.53 1.132 . . . . 0.0 111.254 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.23 112.16 8.42 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.682 1.193 . . . . 0.0 108.45 177.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 56.05 60.52 3.18 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.61 1.564 . . . . 0.0 112.968 -169.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.46 27.06 15.08 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.719 2.408 . . . . 0.0 114.751 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.17 133.8 5.45 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 109.519 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -75.86 105.12 2.02 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.809 3.006 . . . . 0.0 112.137 177.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 m -97.84 14.33 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.834 1.254 . . . . 0.0 111.997 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.7 t-80 -158.42 147.73 19.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.328 1.422 . . . . 0.0 113.025 -167.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -108.77 128.0 54.5 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.007 1.323 . . . . 0.0 111.009 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.4 t -93.66 -58.24 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.027 0.931 . . . . 0.0 110.97 174.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.77 -175.58 46.62 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.448 1.023 . . . . 0.0 112.652 -172.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.9 p -122.79 136.86 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.43 1.092 . . . . 0.0 111.84 -172.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.96 -5.36 3.67 Favored Glycine 0 CA--C 1.541 1.714 0 N-CA-C 116.2 1.24 . . . . 0.0 116.2 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -172.5 165.46 5.65 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 129.929 3.292 . . . . 0.0 109.527 -171.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 83.9 m -101.8 112.22 24.75 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.042 1.337 . . . . 0.0 110.427 173.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.27 80.59 0.27 Allowed Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.6 1.571 . . . . 0.0 112.924 -174.042 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.4 t -89.99 173.97 7.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.546 1.139 . . . . 0.0 113.415 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.05 149.5 8.37 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 127.562 2.505 . . . . 0.0 113.678 176.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 151.79 165.09 12.72 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 125.724 1.631 . . . . 0.0 113.686 176.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.6 m -143.52 90.71 2.18 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.384 1.474 . . . . 0.0 111.521 -172.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.65 5.01 67.37 Favored Glycine 0 CA--C 1.541 1.715 0 C-N-CA 124.521 1.058 . . . . 0.0 115.101 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 90.4 mt -72.26 144.32 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 126.499 1.92 . . . . 0.0 110.095 -178.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -137.64 15.01 2.93 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.33 1.452 . . . . 0.0 114.049 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.1 mp -61.52 -20.99 63.83 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.038 1.735 . . . . 0.0 114.313 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.18 167.15 6.9 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.199 1.4 . . . . 0.0 113.458 170.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.4 m -73.78 -20.67 60.41 Favored 'General case' 0 N--CA 1.479 0.975 0 O-C-N 120.724 -1.235 . . . . 0.0 113.473 176.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 95.4 p 48.09 36.62 6.72 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 127.447 2.299 . . . . 0.0 116.044 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -48.85 -28.12 3.52 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 126.257 1.823 . . . . 0.0 114.452 177.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.9 t -57.72 -21.72 42.4 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.191 1.396 . . . . 0.0 114.347 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.17 107.84 10.75 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.468 1.507 . . . . 0.0 111.056 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.11 1.21 61.3 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.055 1.312 . . . . 0.0 115.375 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -137.66 -165.09 1.72 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.456 1.502 . . . . 0.0 111.438 174.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -154.02 173.61 15.78 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.394 1.478 . . . . 0.0 110.845 -175.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -56.78 -36.99 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.186 2.194 . . . . 0.0 112.215 167.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.47 90.4 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.699 1.2 . . . . 0.0 111.587 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.6 p -82.93 -29.3 29.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.099 1.36 . . . . 0.0 113.532 174.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.56 -43.87 65.5 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.389 1.476 . . . . 0.0 112.699 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.12 -61.58 2.36 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.12 0.968 . . . . 0.0 110.536 173.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.66 -19.86 52.27 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -178.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -70.32 -48.44 56.52 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.764 1.626 . . . . 0.0 112.986 175.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -152.34 22.85 0.63 Allowed 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.8 mt -128.08 144.16 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 120.439 -1.413 . . . . 0.0 109.534 178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.4 t -143.36 156.39 44.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 178.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -91.42 0.83 57.46 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.396 1.878 . . . . 0.0 112.487 167.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.3 t -162.8 112.29 1.38 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.338 1.855 . . . . 0.0 111.185 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.8 ttp-105 -68.0 107.34 2.65 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.545 -1.347 . . . . 0.0 110.673 173.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.47 1.57 13.68 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.142 1.377 . . . . 0.0 113.687 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.0 p -69.92 142.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.07 1.348 . . . . 0.0 112.516 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -130.96 12.16 5.17 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.268 1.827 . . . . 0.0 112.424 169.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.9 m 51.48 40.93 27.9 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.034 2.534 . . . . 0.0 113.152 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -153.25 -38.68 0.1 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.379 2.271 . . . . 0.0 111.362 -174.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -90.97 -8.3 49.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.369 1.067 . . . . 0.0 113.493 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.0 pt -62.15 -10.59 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.347 1.059 . . . . 0.0 113.721 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.83 -36.04 35.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.82 1.648 . . . . 0.0 113.451 166.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 96.0 p -87.3 -14.5 40.68 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 177.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.6 p -86.17 -178.84 6.61 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.221 1.408 . . . . 0.0 111.869 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -70.88 -12.43 61.54 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -85.93 10.02 15.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.031 2.132 . . . . 0.0 114.989 -176.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -67.49 -7.49 26.07 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 127.978 2.511 . . . . 0.0 114.605 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -61.79 0.54 0.35 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.237 2.615 . . . . 0.0 115.846 -174.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.6 t 56.15 30.96 17.38 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.233 1.813 . . . . 0.0 114.2 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.57 154.85 27.63 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.973 1.309 . . . . 0.0 112.616 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -63.96 -33.72 76.36 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.922 1.289 . . . . 0.0 114.322 -169.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.3 pttm -162.01 163.79 28.66 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.559 1.544 . . . . 0.0 111.901 166.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -132.94 159.31 40.34 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.574 0.749 . . . . 0.0 110.674 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.0 m -122.73 90.41 3.29 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.363 1.065 . . . . 0.0 110.332 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -77.42 119.93 21.72 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.638 0.775 . . . . 0.0 111.134 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.6 mt -96.08 112.92 29.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 125.645 1.578 . . . . 0.0 107.65 173.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -80.5 89.61 5.64 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.532 -0.73 . . . . 0.0 109.783 167.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.0 m -149.0 159.2 44.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.56 1.144 . . . . 0.0 112.981 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 25.8 mtt-85 -71.14 163.79 62.55 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 124.575 1.15 . . . . 0.0 111.115 164.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.59 -24.2 30.69 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 122.301 2.0 . . . . 0.0 114.201 176.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.61 -56.37 30.35 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 117.921 -1.038 . . . . 0.0 113.091 -175.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.79 -0.39 6.87 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.983 2.455 . . . . 0.0 114.826 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -102.9 -54.44 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.323 1.849 . . . . 0.0 109.749 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -45.53 78.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.209 -0.932 . . . . 0.0 112.848 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.56 35.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -172.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.09 -35.68 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 123.642 0.777 . . . . 0.0 110.599 169.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.3 p -111.07 157.42 20.0 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.864 1.266 . . . . 0.0 113.217 172.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -155.37 106.25 2.54 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.583 1.953 . . . . 0.0 109.875 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.6 3.24 86.49 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.39 0.995 . . . . 0.0 114.754 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.2 mt -76.12 116.05 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.706 1.202 . . . . 0.0 110.86 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 17.9 mt -105.54 -18.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 126.447 1.899 . . . . 0.0 110.807 173.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.12 8.87 1.12 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 128.095 2.558 . . . . 0.0 116.909 -166.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 8.7 t 50.7 62.08 2.89 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.895 1.225 . . . . 0.0 113.48 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -157.55 154.62 28.87 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 125.919 1.687 . . . . 0.0 111.242 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -138.09 -170.54 2.82 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.869 -1.145 . . . . 0.0 111.534 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.85 141.92 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 125.75 1.62 . . . . 0.0 108.524 173.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.6 tp -51.01 140.96 14.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.29 1.036 . . . . 0.0 111.72 169.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.58 170.85 2.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 122.583 1.183 . . . . 0.0 113.508 172.193 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.8 p -118.26 -30.89 5.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.567 1.947 . . . . 0.0 113.353 -176.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.5 m -80.52 171.08 15.5 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.711 1.604 . . . . 0.0 112.086 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -118.48 110.09 17.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.796 1.238 . . . . 0.0 111.164 -176.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -104.75 161.08 14.47 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.809 1.644 . . . . 0.0 110.374 -173.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -71.47 109.14 5.25 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.876 -0.515 . . . . 0.0 110.417 -179.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.28 126.62 48.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.668 1.187 . . . . 0.0 112.003 -176.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 30.1 t -128.76 91.48 3.23 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.326 1.45 . . . . 0.0 109.855 -174.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -82.21 161.85 22.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.851 0.834 . . . . 0.0 110.407 169.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.58 128.73 11.15 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.04 -1.037 . . . . 0.0 109.484 157.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -116.96 136.87 52.61 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.406 1.083 . . . . 0.0 110.114 -173.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 20.6 t -60.5 147.35 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-O 121.451 0.643 . . . . 0.0 112.043 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.8 t -137.64 101.8 4.58 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.049 1.34 . . . . 0.0 111.269 172.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.0 p . . . . . 0 C--O 1.254 1.305 0 C-N-CA 126.591 1.956 . . . . 0.0 114.403 178.93 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 119.285 -0.388 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -74.73 -51.22 0.13 Allowed 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.44 2.093 . . . . 0.0 113.522 -168.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.68 -167.34 2.11 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.752 2.421 . . . . 0.0 109.217 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.12 149.41 42.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.736 1.214 . . . . 0.0 109.845 167.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -142.73 159.08 42.93 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.888 1.675 . . . . 0.0 110.213 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -99.11 157.21 16.51 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.481 1.112 . . . . 0.0 113.061 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.95 103.35 14.59 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.367 1.467 . . . . 0.0 111.093 -169.307 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -127.98 114.72 17.49 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.457 1.503 . . . . 0.0 111.118 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -130.86 147.67 52.54 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.05 1.74 . . . . 0.0 110.865 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.6 t -151.11 170.3 19.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.842 1.657 . . . . 0.0 110.987 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.4 m -139.7 100.86 4.06 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.479 -0.763 . . . . 0.0 110.768 173.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.93 176.74 9.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.833 1.253 . . . . 0.0 113.519 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.25 170.3 3.87 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.471 2.308 . . . . 0.0 113.608 171.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.9 p90 -141.15 142.18 34.08 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.122 1.769 . . . . 0.0 111.541 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.5 t -100.52 142.71 31.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.801 0.81 . . . . 0.0 111.413 174.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.8 m -147.24 -178.3 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 126.564 1.945 . . . . 0.0 110.983 -178.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -126.49 117.37 22.74 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.93 1.292 . . . . 0.0 111.532 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -87.1 133.0 33.66 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.658 0.783 . . . . 0.0 111.704 174.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -139.89 113.63 8.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.261 1.425 . . . . 0.0 108.501 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 59.47 56.7 3.6 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.402 1.481 . . . . 0.0 112.416 -169.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.12 24.81 13.57 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.629 2.372 . . . . 0.0 115.1 169.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.1 132.7 5.32 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.855 1.262 . . . . 0.0 109.639 -174.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.45 109.05 2.79 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.565 2.843 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 4.0 m -108.52 18.2 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.692 1.997 . . . . 0.0 112.518 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -156.51 137.31 13.37 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.659 -1.276 . . . . 0.0 110.826 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -80.69 153.82 27.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.056 0.389 . . . . 0.0 110.452 167.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.9 -54.54 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.216 1.006 . . . . 0.0 112.155 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.45 -172.28 43.43 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.259 0.936 . . . . 0.0 114.677 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -125.91 129.04 72.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 125.413 1.485 . . . . 0.0 109.99 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.17 -4.58 4.56 Favored Glycine 0 CA--C 1.539 1.565 0 N-CA-C 116.664 1.426 . . . . 0.0 116.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.0 m -162.43 162.96 27.88 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.558 3.143 . . . . 0.0 109.869 -172.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 90.2 m -106.6 120.19 41.29 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.212 1.405 . . . . 0.0 109.771 167.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.44 145.56 50.0 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 123.358 0.504 . . . . 0.0 112.233 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.5 t -145.35 159.77 42.55 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.072 1.349 . . . . 0.0 111.476 178.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 154.16 -173.27 32.75 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.475 1.512 . . . . 0.0 113.253 -174.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -142.78 88.85 0.18 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 125.487 1.517 . . . . 0.0 112.137 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 91.6 p -136.13 169.85 16.96 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.716 1.606 . . . . 0.0 112.946 -178.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -104.39 16.41 48.85 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.853 1.692 . . . . 0.0 115.062 -175.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 73.0 mt -62.83 137.13 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.458 1.503 . . . . 0.0 110.748 -174.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 30.9 p90 -135.68 5.94 3.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.087 1.755 . . . . 0.0 113.675 -175.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.57 -16.12 61.26 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.64 1.576 . . . . 0.0 112.612 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -67.64 163.64 20.93 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.068 1.347 . . . . 0.0 113.093 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 33.3 m -66.65 -33.75 76.35 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.012 0.925 . . . . 0.0 111.824 175.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.8 t 34.27 71.61 0.1 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 128.631 2.772 . . . . 0.0 114.036 -172.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.2 mp -57.79 -10.63 1.76 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.87 1.668 . . . . 0.0 115.111 -178.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.2 p -57.76 -38.88 76.18 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.035 1.334 . . . . 0.0 114.138 171.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -117.33 107.13 14.01 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.073 1.749 . . . . 0.0 110.951 -178.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.96 2.58 62.51 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 124.954 1.264 . . . . 0.0 115.264 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.21 -166.99 2.08 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.986 1.393 . . . . 0.0 111.482 173.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -153.98 173.38 16.06 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.563 1.545 . . . . 0.0 110.348 -178.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -56.67 -36.57 69.74 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.481 1.912 . . . . 0.0 112.357 168.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -45.08 89.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.034 1.334 . . . . 0.0 111.413 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.2 p -80.43 -30.94 37.64 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.854 1.262 . . . . 0.0 113.427 173.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -53.49 -44.14 68.79 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.318 1.447 . . . . 0.0 113.131 177.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -53.45 -61.58 2.21 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.147 0.979 . . . . 0.0 110.421 172.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -59.29 -20.06 51.29 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -72.66 -52.7 14.25 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.155 1.782 . . . . 0.0 113.856 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -133.14 7.88 3.99 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -175.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.4 mt -127.5 147.5 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 120.541 -1.349 . . . . 0.0 110.108 -172.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 12.5 t -143.34 154.99 44.31 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 174.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -91.18 0.52 57.51 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.194 1.798 . . . . 0.0 112.359 168.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.45 114.3 2.14 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.196 1.799 . . . . 0.0 111.192 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -67.93 103.39 1.47 Allowed 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.563 -1.336 . . . . 0.0 110.506 172.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -113.56 4.85 16.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.447 1.499 . . . . 0.0 113.046 177.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.6 t -79.74 142.55 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.434 1.093 . . . . 0.0 111.47 -176.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -128.71 9.66 5.95 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.032 1.733 . . . . 0.0 112.504 175.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 15.8 m 52.49 44.34 30.08 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.52 2.328 . . . . 0.0 113.043 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.7 -25.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.992 2.117 . . . . 0.0 113.245 -177.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -101.05 -5.05 26.28 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.751 1.22 . . . . 0.0 113.717 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.3 pt -61.41 -11.96 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.89 1.276 . . . . 0.0 114.005 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -57.37 -28.9 63.58 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.832 0.853 . . . . 0.0 112.923 167.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 t -83.82 1.26 43.92 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.01 1.724 . . . . 0.0 114.234 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.0 p -117.4 -177.02 3.13 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.611 1.565 . . . . 0.0 111.882 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -63.48 -17.85 63.16 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.14 -0.975 . . . . 0.0 113.539 171.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.77 11.71 25.99 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.204 1.802 . . . . 0.0 114.199 -170.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -63.3 -8.84 9.49 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.789 2.435 . . . . 0.0 115.313 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -62.28 -10.11 9.96 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.082 1.753 . . . . 0.0 114.759 -173.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 46.1 t 39.66 59.01 1.93 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.994 2.117 . . . . 0.0 113.234 -166.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.88 161.13 27.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.888 1.275 . . . . 0.0 111.743 162.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.88 -34.06 77.1 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.198 1.399 . . . . 0.0 114.381 -172.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.9 ptmt -160.02 157.05 28.02 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.7 1.6 . . . . 0.0 111.889 167.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -121.44 152.89 38.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.551 0.74 . . . . 0.0 109.42 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.5 m -112.36 98.13 7.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.017 1.327 . . . . 0.0 108.035 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -82.05 136.33 35.23 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.593 -0.692 . . . . 0.0 111.873 176.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.5 mt -109.12 109.7 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 125.942 1.697 . . . . 0.0 107.029 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.34 89.23 6.56 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.536 -0.727 . . . . 0.0 109.456 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 m -149.52 160.21 43.66 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.972 1.309 . . . . 0.0 112.687 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -70.16 163.42 61.86 Favored Pre-proline 0 N--CA 1.47 0.546 0 C-N-CA 124.326 1.05 . . . . 0.0 111.187 164.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.35 -23.55 27.97 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.312 2.008 . . . . 0.0 114.229 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.27 -57.7 23.92 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.088 -177.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.74 0.62 5.36 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.062 2.508 . . . . 0.0 114.855 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.27 -54.65 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.522 1.929 . . . . 0.0 109.748 176.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -46.01 76.29 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.129 -0.982 . . . . 0.0 112.745 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.44 -3.08 31.81 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -172.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.5 mt -53.19 -36.39 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 123.558 0.743 . . . . 0.0 110.403 168.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -107.96 159.0 16.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.084 0.954 . . . . 0.0 113.409 174.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.95 106.69 2.87 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.438 1.895 . . . . 0.0 109.779 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.53 5.08 90.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 124.301 0.953 . . . . 0.0 114.987 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.6 mt -75.85 116.11 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.646 1.179 . . . . 0.0 111.226 -176.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -110.82 -10.94 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 126.577 1.951 . . . . 0.0 111.008 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.14 3.76 5.22 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.447 2.299 . . . . 0.0 116.061 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 52.98 64.46 1.85 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.695 1.598 . . . . 0.0 112.717 -172.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -155.79 158.81 38.75 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.816 2.046 . . . . 0.0 110.968 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -141.51 -167.56 2.45 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.715 -1.241 . . . . 0.0 111.469 163.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -124.51 145.7 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.331 1.452 . . . . 0.0 109.488 167.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -51.94 142.3 15.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.69 1.196 . . . . 0.0 111.944 168.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.22 172.77 2.28 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.7 t -122.66 -25.07 4.76 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.098 1.359 . . . . 0.0 113.931 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.3 m -80.52 170.93 15.69 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.76 1.224 . . . . 0.0 111.993 172.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -117.54 110.96 18.6 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.726 1.21 . . . . 0.0 111.348 -177.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -106.39 161.98 14.09 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.87 1.668 . . . . 0.0 110.603 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -71.57 108.01 4.73 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 121.745 -0.597 . . . . 0.0 110.297 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -99.89 119.21 37.85 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.594 1.558 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.1 t -122.43 97.33 5.41 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.038 1.335 . . . . 0.0 110.459 -171.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -93.52 163.03 13.73 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.512 0.725 . . . . 0.0 111.067 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.82 107.85 3.22 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.496 -0.753 . . . . 0.0 111.875 163.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -92.58 132.41 36.88 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.606 1.163 . . . . 0.0 111.215 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.0 t -56.72 148.07 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.509 1.523 . . . . 0.0 112.008 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.1 p -118.11 86.88 2.61 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.905 1.282 . . . . 0.0 111.684 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 32.2 p . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.833 1.653 . . . . 0.0 114.151 173.459 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 38.3 ptt85 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.749 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.73 -59.99 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 121.512 1.475 . . . . 0.0 112.027 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 m -140.89 175.78 9.34 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.357 1.863 . . . . 0.0 110.417 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -97.42 130.07 44.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.522 1.129 . . . . 0.0 110.516 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -134.33 160.63 37.34 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.9 1.28 . . . . 0.0 112.205 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -109.57 153.14 24.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.536 1.934 . . . . 0.0 112.443 177.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.52 112.83 19.79 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.319 1.848 . . . . 0.0 111.727 -170.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -139.56 103.29 4.66 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.455 . . . . 0.0 112.275 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -124.32 149.82 46.15 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.316 1.046 . . . . 0.0 111.656 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.1 t -148.79 174.81 11.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.603 1.561 . . . . 0.0 111.9 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.1 m -140.45 102.87 4.43 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.032 0.933 . . . . 0.0 110.997 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.66 170.22 9.6 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.916 1.286 . . . . 0.0 113.45 -172.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 170.85 1.11 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.911 2.484 . . . . 0.0 113.617 168.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.22 147.65 35.19 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.369 1.868 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 t -106.1 141.91 36.68 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.063 0.945 . . . . 0.0 111.607 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.7 m -145.75 -179.4 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.175 1.79 . . . . 0.0 111.876 -175.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.3 m -127.17 118.55 24.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.144 0.978 . . . . 0.0 111.954 176.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.8 t -87.36 127.73 35.2 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.204 1.002 . . . . 0.0 111.794 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -135.58 114.72 12.3 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.057 1.343 . . . . 0.0 109.107 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 57.25 57.04 4.72 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 112.535 -172.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 64.33 26.66 13.67 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.468 2.307 . . . . 0.0 114.719 170.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.41 135.08 6.56 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.961 1.304 . . . . 0.0 109.548 -177.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.56 107.85 2.57 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.714 2.943 . . . . 0.0 112.564 177.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.9 m -100.76 6.46 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.495 1.518 . . . . 0.0 112.236 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -148.53 146.62 28.4 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.797 1.635 . . . . 0.0 112.592 -175.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -103.0 131.7 49.79 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.732 1.213 . . . . 0.0 111.108 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -104.52 -52.96 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.146 0.978 . . . . 0.0 112.084 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.62 -172.58 44.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 119.098 0.863 . . . . 0.0 114.924 -173.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.8 t -123.69 124.01 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.724 1.61 . . . . 0.0 110.354 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 65.78 3.62 16.41 Favored Glycine 0 CA--C 1.54 1.594 0 N-CA-C 115.864 1.105 . . . . 0.0 115.864 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.5 m -169.88 163.75 9.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 128.62 2.768 . . . . 0.0 110.382 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -103.98 105.86 16.18 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.574 1.55 . . . . 0.0 110.532 172.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.7 71.1 0.21 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 125.51 1.528 . . . . 0.0 113.166 -173.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -68.51 161.97 26.68 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.106 0.962 . . . . 0.0 112.395 173.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 164.49 -179.25 39.36 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.242 1.401 . . . . 0.0 113.805 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -126.17 106.2 0.84 Allowed Glycine 0 CA--C 1.532 1.104 0 C-N-CA 126.107 1.813 . . . . 0.0 111.774 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.6 t -140.01 171.45 14.17 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.234 1.414 . . . . 0.0 112.138 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -90.8 6.96 81.87 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.099 1.809 . . . . 0.0 115.37 -176.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 66.7 mt -60.0 136.05 24.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.797 1.639 . . . . 0.0 111.553 -174.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -142.22 18.42 2.08 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 126.575 1.95 . . . . 0.0 112.555 177.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.6 mt -70.89 -17.11 62.72 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.999 1.32 . . . . 0.0 114.443 -170.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -120.24 174.93 6.21 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.016 1.727 . . . . 0.0 112.586 167.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.6 m -57.03 -23.87 49.59 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.397 1.879 . . . . 0.0 113.435 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.5 t 42.91 68.37 0.51 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 128.091 2.556 . . . . 0.0 112.648 179.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.425 HD11 ' H ' ' A' ' 45' ' ' LEU . 3.7 mp -51.39 106.09 0.13 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.873 2.069 . . . . 0.0 111.015 -176.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.2 t -155.44 -64.62 0.12 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.56 1.144 . . . . 0.0 111.382 -173.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.97 115.78 31.07 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.506 1.523 . . . . 0.0 110.619 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 74.89 10.35 83.69 Favored Glycine 0 CA--C 1.539 1.568 0 C-N-CA 124.175 0.893 . . . . 0.0 115.242 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 51.4 m -109.08 172.53 6.79 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.475 1.51 . . . . 0.0 111.34 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -155.66 168.52 26.91 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 123.429 1.585 . . . . 0.0 113.092 -177.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -57.18 -33.7 67.72 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.181 2.192 . . . . 0.0 113.787 174.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.96 -46.13 89.19 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.097 -1.002 . . . . 0.0 110.62 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.2 p -76.9 -26.53 54.24 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 173.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -52.81 -46.01 67.51 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.57 1.548 . . . . 0.0 112.46 175.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -56.96 -60.66 3.25 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.072 0.949 . . . . 0.0 110.791 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.99 -24.94 60.22 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.37 -54.58 22.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.649 1.58 . . . . 0.0 114.047 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -146.9 20.22 1.27 Allowed 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.3 mt -126.72 150.19 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.063 1.345 . . . . 0.0 109.701 173.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 t -141.68 151.9 43.42 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -84.03 -3.71 58.22 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.604 1.562 . . . . 0.0 112.909 170.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.0 t -162.26 118.26 1.97 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.255 1.822 . . . . 0.0 110.991 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.9 ttp-105 -69.0 100.31 1.2 Allowed 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.515 -1.365 . . . . 0.0 111.389 174.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -107.52 4.18 25.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.568 1.547 . . . . 0.0 113.171 173.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.5 t -75.45 138.72 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.327 1.451 . . . . 0.0 111.426 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -126.68 4.56 6.74 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.794 1.638 . . . . 0.0 113.155 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.6 m 54.16 35.78 23.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.98 2.112 . . . . 0.0 113.321 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -153.52 -27.38 0.14 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.742 2.417 . . . . 0.0 112.513 -172.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -115.06 3.88 14.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.146 1.778 . . . . 0.0 114.27 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.9 pt -63.57 -8.33 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.219 1.407 . . . . 0.0 113.617 174.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.9 ttt -54.1 -28.15 37.55 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.955 1.302 . . . . 0.0 112.752 162.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 t -92.98 -0.7 57.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.153 1.781 . . . . 0.0 114.215 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.8 p -114.76 -175.59 2.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.385 1.474 . . . . 0.0 111.4 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -64.15 -15.91 60.78 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 120.935 -1.103 . . . . 0.0 113.711 176.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -100.28 17.72 20.66 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.167 1.787 . . . . 0.0 114.24 -164.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -68.85 -7.64 36.31 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 128.984 2.914 . . . . 0.0 114.682 -173.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -63.28 2.26 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 128.179 2.592 . . . . 0.0 115.817 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.2 t 56.79 27.92 13.57 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.263 1.825 . . . . 0.0 114.117 -176.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 154.93 17.68 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.131 1.372 . . . . 0.0 112.207 177.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.7 -33.97 77.21 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.9 ptmm? -161.37 160.03 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.905 1.682 . . . . 0.0 112.676 167.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -131.03 125.37 33.09 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.377 1.071 . . . . 0.0 109.766 163.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -87.64 95.2 9.97 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.546 1.138 . . . . 0.0 109.964 171.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -82.5 127.83 33.7 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.878 -0.514 . . . . 0.0 111.455 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 61.8 mt -97.93 114.92 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 125.015 1.326 . . . . 0.0 107.845 172.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.26 87.45 7.14 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.46 0.704 . . . . 0.0 110.203 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.2 m -144.94 165.63 27.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.739 2.015 . . . . 0.0 112.549 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -74.22 164.28 62.35 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 124.339 1.056 . . . . 0.0 110.761 161.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.28 -23.98 17.2 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.509 2.139 . . . . 0.0 114.147 174.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.21 -55.59 44.73 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 124.419 1.088 . . . . 0.0 113.466 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.46 -1.51 9.18 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 123.107 2.538 . . . . 0.0 114.575 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.55 -54.24 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 126.249 1.819 . . . . 0.0 109.398 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -45.33 81.22 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.25 -0.906 . . . . 0.0 112.912 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.85 -3.63 36.28 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -171.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 52.8 mt -53.93 -35.34 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 123.609 0.764 . . . . 0.0 110.665 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 21.0 p -111.39 158.43 19.08 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.245 1.418 . . . . 0.0 113.118 173.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -155.56 112.99 3.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.978 1.711 . . . . 0.0 110.402 175.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.09 2.95 90.57 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.666 1.127 . . . . 0.0 114.97 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 50.6 mt -77.33 118.53 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.967 1.307 . . . . 0.0 111.063 -176.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.0 mt -111.15 -13.1 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.595 1.958 . . . . 0.0 111.046 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.2 1.96 6.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.389 2.276 . . . . 0.0 116.355 -168.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.66 68.47 0.82 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.594 1.558 . . . . 0.0 112.431 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -158.06 149.36 21.22 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.361 1.864 . . . . 0.0 110.516 -176.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -140.4 -168.1 2.48 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.643 -1.286 . . . . 0.0 111.364 164.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -126.36 149.38 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 125.636 1.575 . . . . 0.0 109.729 168.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.4 tp -53.47 142.39 22.28 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.75 1.22 . . . . 0.0 111.644 168.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.52 173.24 1.7 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 173.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.6 t -124.9 -23.38 4.29 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.755 1.222 . . . . 0.0 114.177 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.9 m -79.59 170.52 16.43 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.38 1.072 . . . . 0.0 111.498 169.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -124.73 104.94 8.93 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.139 0.976 . . . . 0.0 111.522 -173.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -101.65 163.11 12.43 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.058 2.143 . . . . 0.0 110.798 -171.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -75.6 105.89 6.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.597 -0.689 . . . . 0.0 110.669 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.81 119.47 35.34 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.834 1.253 . . . . 0.0 111.667 178.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.8 t -119.64 87.63 2.78 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 126.041 1.736 . . . . 0.0 110.001 -171.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.9 163.94 21.9 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.325 1.06 . . . . 0.0 111.318 168.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -154.99 124.45 6.41 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.67 1.588 . . . . 0.0 108.689 162.511 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -111.04 139.39 46.44 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.357 1.063 . . . . 0.0 109.909 -175.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 16.0 t -60.99 148.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.754 0.822 . . . . 0.0 111.89 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.2 t -140.48 86.05 2.04 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-O 122.694 1.235 . . . . 0.0 111.867 173.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.255 1.389 0 C-N-CA 125.745 1.618 . . . . 0.0 111.993 174.664 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.26 -51.1 0.12 Allowed 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 122.496 2.13 . . . . 0.0 113.165 -164.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -141.11 167.49 22.06 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.701 2.4 . . . . 0.0 109.204 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.511 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.3 mmpt? -93.43 143.86 25.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.533 0.733 . . . . 0.0 111.174 172.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -138.25 161.64 36.36 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.557 1.543 . . . . 0.0 111.473 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -97.43 154.23 17.61 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 127.297 2.239 . . . . 0.0 110.863 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.2 tp -79.83 128.47 33.48 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.964 0.906 . . . . 0.0 111.062 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.9 tptt -148.66 97.08 2.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.519 1.528 . . . . 0.0 111.771 173.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -110.72 142.52 42.53 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.819 1.247 . . . . 0.0 110.931 175.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 38.7 m -153.42 172.69 16.71 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.971 1.708 . . . . 0.0 111.066 -176.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 m -145.44 101.57 3.6 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.969 -1.082 . . . . 0.0 110.885 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.28 175.12 8.51 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.034 1.333 . . . . 0.0 113.316 -176.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.12 170.7 3.44 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 128.215 2.606 . . . . 0.0 113.801 171.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -140.06 142.56 36.15 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.116 1.767 . . . . 0.0 111.802 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -101.62 141.82 33.91 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.855 0.862 . . . . 0.0 111.405 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.2 m -146.75 -178.95 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 126.32 1.848 . . . . 0.0 111.282 -175.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.2 m -125.68 117.92 24.53 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.436 1.094 . . . . 0.0 111.194 174.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -84.4 134.57 34.47 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.564 0.697 . . . . 0.0 111.336 172.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.75 114.62 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.421 1.489 . . . . 0.0 108.403 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 57.98 55.78 5.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.668 1.187 . . . . 0.0 112.504 -171.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.9 24.43 11.23 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 127.655 2.382 . . . . 0.0 115.189 169.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.16 133.41 6.14 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 124.914 1.285 . . . . 0.0 109.421 -176.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.04 103.39 1.73 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.71 2.94 . . . . 0.0 112.354 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 m -98.41 10.08 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.178 1.391 . . . . 0.0 112.288 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -150.62 143.66 24.75 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.851 1.659 . . . . 0.0 112.295 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -98.2 137.12 37.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.217 1.007 . . . . 0.0 111.29 174.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -110.86 -53.77 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.97 0.908 . . . . 0.0 111.754 178.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.38 -171.12 42.91 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-N 118.782 0.719 . . . . 0.0 114.227 -174.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.14 129.45 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 0.0 109.799 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.16 0.21 7.19 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -168.58 164.27 12.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.577 2.351 . . . . 0.0 110.645 -174.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.5 m -110.35 113.61 26.41 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.994 1.718 . . . . 0.0 111.419 173.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.12 104.84 1.88 Allowed Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.941 1.258 . . . . 0.0 112.345 175.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.9 t -60.12 148.98 34.02 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.43 1.092 . . . . 0.0 113.129 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.18 -88.39 0.12 Allowed Glycine 0 CA--C 1.536 1.381 0 C-N-CA 125.972 1.749 . . . . 0.0 112.618 -175.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -178.58 163.67 31.7 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 126.402 1.953 . . . . 0.0 111.949 172.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 97.5 p -74.0 167.27 21.85 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.99 -0.712 . . . . 0.0 112.305 173.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.74 -17.14 80.04 Favored Glycine 0 CA--C 1.537 1.456 0 O-C-N 121.529 -0.732 . . . . 0.0 114.094 174.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.7 mp -82.21 135.24 25.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 C-N-CA 125.549 1.539 . . . . 0.0 110.261 177.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -135.46 14.13 3.47 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.558 1.543 . . . . 0.0 113.237 177.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 87.8 mt -64.71 -20.79 66.53 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.171 1.788 . . . . 0.0 113.93 -177.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -109.97 158.21 18.47 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.376 1.47 . . . . 0.0 111.594 168.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.7 m -71.38 -27.16 63.14 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.469 0.708 . . . . 0.0 112.2 175.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 7.3 t 57.89 16.24 3.53 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.447 1.899 . . . . 0.0 114.385 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.1 mp 56.27 97.36 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.313 3.045 . . . . 0.0 111.884 -171.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.2 t -138.4 -61.22 0.6 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.251 1.02 . . . . 0.0 112.624 -170.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -116.49 123.04 46.47 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.464 1.506 . . . . 0.0 110.54 178.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.44 7.18 72.52 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 124.36 0.981 . . . . 0.0 115.287 -177.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 50.2 m -101.37 171.87 7.33 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.209 1.404 . . . . 0.0 111.554 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -154.44 167.51 29.78 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 123.107 1.432 . . . . 0.0 112.94 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -59.44 -34.05 72.03 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.436 1.895 . . . . 0.0 113.715 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.09 -44.73 96.04 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.982 -1.073 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 p -76.18 -28.02 57.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.05 1.34 . . . . 0.0 113.965 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -52.44 -45.19 65.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.65 1.568 . . . . 0.0 112.749 176.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.58 -62.81 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.447 1.099 . . . . 0.0 110.629 173.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -60.55 -19.78 58.37 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.67 -51.15 44.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.176 1.79 . . . . 0.0 113.769 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -151.24 23.4 0.73 Allowed 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -174.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -127.99 148.9 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 125.493 1.517 . . . . 0.0 109.367 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -146.74 156.95 43.55 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -92.74 2.7 56.6 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.227 1.811 . . . . 0.0 112.403 169.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.03 114.06 2.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.216 1.806 . . . . 0.0 111.089 172.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.6 ttp-105 -66.58 106.33 1.76 Allowed 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.675 -1.266 . . . . 0.0 110.643 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -116.05 4.16 13.68 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.353 1.461 . . . . 0.0 113.346 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.3 p -75.91 145.69 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.392 1.077 . . . . 0.0 112.978 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -130.88 6.85 4.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.24 1.816 . . . . 0.0 112.943 173.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 m 50.78 47.7 24.08 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 127.589 2.355 . . . . 0.0 113.53 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.12 -28.23 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.651 2.38 . . . . 0.0 112.323 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -103.65 0.44 30.7 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.183 1.393 . . . . 0.0 113.563 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.7 pt -62.81 -11.53 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.095 1.358 . . . . 0.0 113.706 177.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -54.67 -31.3 57.5 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.238 1.015 . . . . 0.0 112.899 165.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.1 m -82.39 1.71 35.95 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.219 1.408 . . . . 0.0 114.527 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.7 p -118.0 -176.12 2.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.895 1.678 . . . . 0.0 111.715 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -64.86 -19.12 65.72 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.21 13.08 12.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.364 1.866 . . . . 0.0 114.208 -172.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -66.31 -9.74 35.95 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.032 2.133 . . . . 0.0 114.82 -172.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -7.75 3.78 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.625 2.37 . . . . 0.0 115.554 -173.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.0 t 39.11 58.69 1.8 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 126.793 2.037 . . . . 0.0 113.635 -168.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.91 160.98 29.72 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.136 1.374 . . . . 0.0 112.025 162.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.84 -31.27 71.77 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -170.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -160.12 156.23 26.42 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.402 1.481 . . . . 0.0 111.959 169.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -132.1 112.68 12.53 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.115 0.966 . . . . 0.0 111.032 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.8 m -83.43 96.71 8.64 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.442 0.697 . . . . 0.0 110.439 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -80.64 132.87 35.65 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 122.835 0.454 . . . . 0.0 111.233 173.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 78.1 mt -104.95 113.54 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.196 1.398 . . . . 0.0 107.661 171.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -85.6 86.43 7.37 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.313 0.578 . . . . 0.0 109.614 167.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -150.39 167.42 27.14 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.95 1.3 . . . . 0.0 112.518 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -79.85 160.68 68.53 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 126.059 1.744 . . . . 0.0 110.536 175.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -70.54 -22.84 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.076 1.851 . . . . 0.0 114.593 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.32 -57.14 21.7 Favored Pre-proline 0 N--CA 1.473 0.721 0 C-N-CA 124.214 1.006 . . . . 0.0 112.977 -178.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.04 -0.27 5.34 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.212 2.608 . . . . 0.0 114.897 178.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.6 t -101.33 -54.9 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.584 1.953 . . . . 0.0 109.736 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -45.78 78.55 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.288 -0.883 . . . . 0.0 112.924 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.53 -2.96 31.46 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.4 mt -53.41 -35.87 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.618 0.767 . . . . 0.0 110.486 169.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.1 p -109.56 158.93 17.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.415 1.086 . . . . 0.0 113.222 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -155.57 103.27 2.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.114 1.766 . . . . 0.0 109.899 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.93 4.57 84.51 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.389 0.995 . . . . 0.0 114.807 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.2 mt -74.93 114.76 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.599 1.2 . . . . 0.0 111.113 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.93 -15.13 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 126.717 2.007 . . . . 0.0 110.68 171.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.54 23.92 0.21 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.666 2.787 . . . . 0.0 115.45 -171.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.2 p 41.28 64.63 0.97 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.334 1.854 . . . . 0.0 114.069 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.6 158.7 40.13 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.709 1.603 . . . . 0.0 111.215 -177.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -142.34 -170.63 3.22 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.738 -1.226 . . . . 0.0 111.796 160.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -124.09 139.58 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.541 1.537 . . . . 0.0 108.705 171.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.85 140.17 12.22 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.551 1.14 . . . . 0.0 111.906 170.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.4 172.28 1.59 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.1 t -119.55 -29.65 5.04 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.969 1.308 . . . . 0.0 113.366 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.7 m -77.14 169.58 18.08 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.305 1.442 . . . . 0.0 112.171 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -117.83 107.39 14.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.442 1.097 . . . . 0.0 111.22 -177.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -100.55 161.81 13.35 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.729 1.612 . . . . 0.0 110.595 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -72.1 106.38 4.32 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.285 0.564 . . . . 0.0 110.294 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -97.63 122.19 40.42 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.498 1.519 . . . . 0.0 110.889 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 37.8 t -126.14 93.63 3.87 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.512 1.525 . . . . 0.0 109.312 -173.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -93.69 163.09 13.68 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.286 1.041 . . . . 0.0 111.057 172.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -148.51 134.8 19.44 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.54 1.536 . . . . 0.0 108.429 164.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.3 m-80 -118.27 127.94 54.2 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.512 1.125 . . . . 0.0 110.391 -175.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.27 144.85 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.657 0.783 . . . . 0.0 111.874 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -135.31 103.51 5.53 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.919 1.287 . . . . 0.0 111.197 173.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.255 1.351 0 C-N-CA 126.238 1.815 . . . . 0.0 112.394 179.662 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.592 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -68.08 -43.57 4.68 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.205 1.937 . . . . 0.0 112.239 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.79 168.82 18.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.466 1.906 . . . . 0.0 110.207 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -88.79 127.96 35.63 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.653 1.181 . . . . 0.0 111.161 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -138.79 155.32 48.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.422 1.089 . . . . 0.0 113.336 179.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -93.77 155.41 17.24 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.254 2.222 . . . . 0.0 111.725 179.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.39 114.5 21.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.678 1.591 . . . . 0.0 111.675 176.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -139.34 114.87 9.89 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.582 1.553 . . . . 0.0 111.338 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -132.74 147.39 52.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.742 1.617 . . . . 0.0 111.179 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.8 m -156.86 171.86 19.67 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.535 1.934 . . . . 0.0 111.683 -177.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -142.38 105.02 4.51 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.548 -0.72 . . . . 0.0 111.103 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.68 173.98 5.16 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.051 1.34 . . . . 0.0 113.397 -170.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.9 173.43 0.77 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.596 2.358 . . . . 0.0 114.273 168.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.9 p90 -144.14 145.34 32.05 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.022 2.129 . . . . 0.0 111.441 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 t -107.17 143.94 34.62 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.915 0.864 . . . . 0.0 112.441 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.0 m -149.22 -179.39 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 126.621 1.968 . . . . 0.0 111.62 -171.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 m -126.36 120.53 30.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.148 0.979 . . . . 0.0 111.336 174.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.31 132.69 34.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.961 0.905 . . . . 0.0 111.277 174.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -136.85 121.72 18.76 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.229 1.412 . . . . 0.0 108.53 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 55.43 53.76 9.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.614 1.165 . . . . 0.0 112.46 -171.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 64.91 26.45 12.82 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.379 2.271 . . . . 0.0 115.04 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -156.54 132.78 6.0 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.806 1.243 . . . . 0.0 109.587 -176.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -76.06 105.37 2.07 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.735 2.957 . . . . 0.0 112.283 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.3 m -104.61 15.83 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.688 1.595 . . . . 0.0 112.397 -179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -154.96 145.74 22.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.696 1.135 . . . . 0.0 112.114 -176.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -102.15 137.53 40.29 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.534 1.134 . . . . 0.0 111.356 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 43.9 t -111.87 -52.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.926 0.89 . . . . 0.0 112.539 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.23 -172.43 43.45 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-N 119.194 0.906 . . . . 0.0 115.198 -171.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t -128.19 126.82 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.976 1.71 . . . . 0.0 110.786 -170.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.51 -13.12 5.2 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.746 1.165 . . . . 0.0 115.753 176.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.6 m -163.35 169.61 18.78 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 130.926 3.691 . . . . 0.0 108.469 -164.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 t -128.33 128.45 44.59 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.045 0.938 . . . . 0.0 111.383 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.52 172.98 16.54 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.366 1.46 . . . . 0.0 114.305 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.0 t -150.06 178.14 9.22 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.818 1.647 . . . . 0.0 111.768 177.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -169.73 179.85 41.89 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 125.947 1.736 . . . . 0.0 113.325 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -148.87 46.87 0.66 Allowed Glycine 0 CA--C 1.534 1.237 0 C-N-CA 124.913 1.244 . . . . 0.0 113.932 -174.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.3 m -132.65 163.6 28.58 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.597 1.559 . . . . 0.0 112.303 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.19 14.42 39.36 Favored Glycine 0 CA--C 1.539 1.594 0 C-N-CA 125.55 1.547 . . . . 0.0 115.733 -177.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.4 mt -62.72 141.36 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.309 1.844 . . . . 0.0 111.099 -175.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -140.01 15.95 2.46 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.586 1.554 . . . . 0.0 113.116 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.23 -18.78 63.92 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.9 -1.125 . . . . 0.0 113.606 -177.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -65.32 167.85 7.87 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.021 0.928 . . . . 0.0 113.137 168.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.0 m -62.48 -30.98 71.65 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.811 -1.18 . . . . 0.0 112.913 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 4.5 t 44.82 58.59 3.87 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.997 2.119 . . . . 0.0 113.67 -177.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.6 mp -57.56 -18.49 19.74 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 t -57.03 -26.53 60.47 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.358 1.863 . . . . 0.0 113.876 172.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -132.13 108.95 9.63 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.396 1.478 . . . . 0.0 111.567 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.89 4.36 60.28 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.815 1.197 . . . . 0.0 115.206 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.99 -167.49 2.1 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.085 1.354 . . . . 0.0 112.472 173.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -153.99 170.51 20.91 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.581 1.952 . . . . 0.0 110.307 -177.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.4 ' NE1' ' HE3' ' A' ' 93' ' ' LYS . 2.7 t-105 -56.65 -37.08 70.27 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.477 2.311 . . . . 0.0 112.698 170.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -42.63 91.24 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 0.0 111.357 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.3 p -85.4 -27.14 25.99 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.119 1.368 . . . . 0.0 113.941 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -51.48 -41.68 61.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.283 1.433 . . . . 0.0 112.682 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -57.56 -64.34 0.93 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.026 0.931 . . . . 0.0 110.614 172.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -59.87 -21.0 60.41 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -65.77 -51.44 59.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.307 1.843 . . . . 0.0 112.572 175.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -150.46 22.21 0.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -174.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -128.91 144.67 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.196 -1.565 . . . . 0.0 109.517 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -143.06 153.46 42.96 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -84.38 -0.45 52.72 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.733 1.613 . . . . 0.0 112.714 169.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.7 t -164.09 112.18 1.15 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.259 1.824 . . . . 0.0 111.405 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.6 ttp85 -67.99 104.53 1.76 Allowed 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.429 -1.42 . . . . 0.0 110.583 172.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -116.84 3.31 12.91 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.457 1.503 . . . . 0.0 113.193 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.5 p -73.8 147.4 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.042 1.337 . . . . 0.0 112.573 -179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -134.6 9.18 3.64 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.92 1.688 . . . . 0.0 112.531 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.2 m 51.47 38.68 22.7 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.444 2.298 . . . . 0.0 113.193 -175.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -145.33 -36.17 0.3 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 128.386 2.674 . . . . 0.0 112.655 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -100.08 -4.33 30.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.666 1.586 . . . . 0.0 113.633 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -60.27 -14.59 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.546 1.138 . . . . 0.0 113.637 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.8 ttt -53.91 -26.63 26.1 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.938 1.695 . . . . 0.0 113.568 168.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.0 t -103.49 1.98 33.05 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.95 1.7 . . . . 0.0 113.849 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -103.31 -174.2 2.49 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 125.494 1.518 . . . . 0.0 111.552 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -63.25 -20.62 65.61 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.129 -0.982 . . . . 0.0 113.582 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.38 12.32 27.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.77 1.628 . . . . 0.0 114.059 -166.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -65.2 -5.11 6.09 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.516 2.726 . . . . 0.0 114.914 -176.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.5 t60 -61.27 -4.8 1.31 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.976 2.11 . . . . 0.0 115.069 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.4 t 56.55 33.76 23.21 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.327 1.851 . . . . 0.0 113.77 -177.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 160.08 14.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.377 1.471 . . . . 0.0 112.351 176.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -67.04 -36.45 82.1 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.562 1.145 . . . . 0.0 113.754 -172.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -159.66 159.62 33.24 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.049 1.34 . . . . 0.0 111.841 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -140.52 127.98 21.35 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.383 0.673 . . . . 0.0 110.433 167.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.0 m -92.41 91.95 7.88 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.685 176.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -75.63 125.29 28.74 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.657 0.783 . . . . 0.0 111.043 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 91.5 mt -103.41 115.8 46.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 125.39 1.476 . . . . 0.0 107.661 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -89.49 86.17 6.7 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.67 0.748 . . . . 0.0 109.749 169.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.0 p -146.46 166.59 25.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.092 1.757 . . . . 0.0 111.959 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 29.1 mmm-85 -78.71 161.09 70.52 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 125.092 1.357 . . . . 0.0 110.422 172.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.93 -21.23 32.99 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 122.102 1.868 . . . . 0.0 114.436 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.12 -57.0 23.05 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-O 117.983 -1.008 . . . . 0.0 112.575 -178.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.22 -0.25 5.44 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.25 2.633 . . . . 0.0 115.168 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -100.96 -55.24 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 126.07 1.748 . . . . 0.0 109.833 174.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.4 ' HE3' ' NE1' ' A' ' 51' ' ' TRP . 0.0 OUTLIER -67.09 -44.4 80.11 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.159 -0.963 . . . . 0.0 112.989 -179.204 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.47 -2.96 31.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -173.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.36 -35.77 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.668 0.787 . . . . 0.0 110.483 169.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.3 p -109.67 158.54 17.97 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.414 1.086 . . . . 0.0 113.308 174.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -153.26 107.72 3.12 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.318 1.847 . . . . 0.0 109.833 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.6 5.23 90.06 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.337 0.97 . . . . 0.0 114.786 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.4 mt -75.73 114.74 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.564 1.146 . . . . 0.0 111.028 -177.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.1 mt -109.58 -12.62 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 126.685 1.994 . . . . 0.0 110.861 172.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.99 5.45 3.31 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.665 2.386 . . . . 0.0 116.143 -171.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.4 t 51.39 65.73 1.4 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.58 1.552 . . . . 0.0 112.904 -172.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -154.44 157.93 39.2 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.214 1.806 . . . . 0.0 111.076 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -142.02 -169.98 3.05 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.783 -1.198 . . . . 0.0 111.86 163.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.5 t -124.36 141.87 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.681 1.592 . . . . 0.0 108.7 170.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -51.02 142.31 12.32 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.811 1.245 . . . . 0.0 111.742 169.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.54 172.24 2.17 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.0 t -120.26 -26.28 5.5 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.199 1.399 . . . . 0.0 113.519 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.0 m -81.06 171.01 15.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.492 1.517 . . . . 0.0 112.006 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -116.54 110.56 18.73 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.504 1.122 . . . . 0.0 111.34 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -106.38 158.31 16.98 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.818 1.647 . . . . 0.0 109.893 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.45 110.75 5.53 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.634 -0.666 . . . . 0.0 110.719 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -101.03 125.51 47.65 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.635 1.574 . . . . 0.0 111.766 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 39.0 t -130.8 91.7 3.11 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.386 1.475 . . . . 0.0 110.796 -172.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -85.5 163.32 18.5 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.959 0.885 . . . . 0.0 111.87 170.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -146.05 140.59 26.9 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 158.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -128.82 129.35 45.49 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.983 0.913 . . . . 0.0 109.907 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.83 146.63 8.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.87 0.868 . . . . 0.0 112.687 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.02 77.77 1.68 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 122.926 1.346 . . . . 0.0 111.863 174.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 75.7 m . . . . . 0 C--O 1.252 1.221 0 C-N-CA 127.44 2.296 . . . . 0.0 112.697 177.708 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 . . . . . 0 N--CA 1.493 1.675 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.27 -48.08 0.17 Allowed 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 121.564 1.509 . . . . 0.0 113.642 -171.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 86.9 m -128.53 174.84 9.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 127.224 2.21 . . . . 0.0 109.482 169.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -105.48 145.19 31.21 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.173 1.389 . . . . 0.0 108.625 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.78 158.51 43.85 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.942 1.297 . . . . 0.0 110.923 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -100.11 159.42 15.12 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 113.22 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.57 105.7 17.03 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.654 1.582 . . . . 0.0 111.362 -169.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -131.96 112.47 12.43 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.638 1.575 . . . . 0.0 111.051 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -131.44 141.91 49.91 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.916 1.687 . . . . 0.0 111.016 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.4 m -146.74 168.06 22.31 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.807 1.643 . . . . 0.0 111.348 -175.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -141.15 103.65 4.48 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.572 -0.705 . . . . 0.0 111.296 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.0 173.52 5.06 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.99 1.316 . . . . 0.0 113.068 -169.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.25 171.77 0.96 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.489 2.316 . . . . 0.0 113.841 167.239 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -142.64 147.7 36.21 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.783 2.033 . . . . 0.0 111.197 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.3 t -107.58 141.34 39.19 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.896 0.879 . . . . 0.0 111.341 176.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -146.86 -178.92 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 126.35 1.86 . . . . 0.0 111.25 -175.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.7 m -126.77 119.24 26.39 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 121.257 -0.902 . . . . 0.0 111.45 176.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.2 132.4 34.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.96 0.904 . . . . 0.0 111.668 175.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -140.13 115.67 10.06 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.038 1.335 . . . . 0.0 108.796 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 58.68 56.37 4.24 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.273 1.429 . . . . 0.0 112.397 -169.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 64.54 24.3 13.04 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.737 2.415 . . . . 0.0 115.06 169.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.86 132.71 5.43 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.827 1.251 . . . . 0.0 109.444 -173.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -76.28 106.45 2.26 Favored 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 123.794 2.996 . . . . 0.0 112.189 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 5.9 m -101.38 14.33 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.329 1.452 . . . . 0.0 111.85 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.8 t-80 -158.95 141.8 14.39 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.037 1.29 . . . . 0.0 112.651 -167.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -92.67 146.95 23.27 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.613 0.765 . . . . 0.0 112.096 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.9 t -120.1 -55.7 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 124.146 0.978 . . . . 0.0 112.436 172.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.39 -173.36 42.83 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 119.297 0.953 . . . . 0.0 115.388 -170.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -127.0 122.99 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.97 1.708 . . . . 0.0 110.235 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.54 -0.05 7.44 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 115.959 1.143 . . . . 0.0 115.959 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.1 m -170.29 165.66 8.86 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 129.28 3.032 . . . . 0.0 110.289 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.9 m -106.35 114.32 28.37 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.742 1.617 . . . . 0.0 110.839 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.25 84.09 0.69 Allowed Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.585 1.564 . . . . 0.0 113.02 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 6.1 t -69.86 168.54 14.95 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.292 1.037 . . . . 0.0 112.938 174.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 131.89 -178.2 18.09 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 126.268 1.89 . . . . 0.0 114.352 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 92.75 163.47 37.47 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 126.091 1.805 . . . . 0.0 114.431 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.6 t -155.11 95.81 1.77 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.117 1.367 . . . . 0.0 111.828 -174.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.5 8.62 71.85 Favored Glycine 0 CA--C 1.541 1.671 0 C-N-CA 124.464 1.03 . . . . 0.0 115.499 178.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 65.6 mt -75.03 145.42 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 126.227 1.811 . . . . 0.0 110.209 -177.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 25.4 p90 -135.66 15.06 3.4 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.55 1.54 . . . . 0.0 113.803 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 90.0 mt -61.31 -32.97 72.84 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.467 1.507 . . . . 0.0 113.197 177.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.93 164.12 22.92 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.086 1.355 . . . . 0.0 113.141 172.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.3 m -63.77 -29.59 70.78 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.125 -0.984 . . . . 0.0 113.141 177.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.4 t 51.12 52.16 15.51 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.976 1.71 . . . . 0.0 113.462 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.1 mp -54.46 -20.11 6.97 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.985 1.314 . . . . 0.0 114.277 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.1 m -56.33 -20.75 20.42 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.556 1.942 . . . . 0.0 114.82 171.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.27 110.64 9.05 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.49 1.516 . . . . 0.0 110.927 175.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.79 1.98 63.2 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 124.961 1.267 . . . . 0.0 115.146 -178.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.15 -170.91 2.99 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.971 1.708 . . . . 0.0 110.891 175.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -152.69 172.42 16.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.025 1.73 . . . . 0.0 110.395 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.41 ' NE1' ' HE3' ' A' ' 93' ' ' LYS . 2.5 t-105 -53.74 -36.56 62.44 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 127.079 2.152 . . . . 0.0 112.274 168.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.32 -45.44 93.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.809 0.844 . . . . 0.0 111.015 177.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.9 p -72.01 -35.61 69.47 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -54.14 -44.11 71.13 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.463 1.505 . . . . 0.0 113.065 -177.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.14 -62.04 1.91 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.367 1.067 . . . . 0.0 110.725 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.65 -20.29 63.24 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -179.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -68.62 -54.78 14.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 113.437 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -133.17 6.7 3.9 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -172.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.12 147.49 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 O-C-N 120.387 -1.446 . . . . 0.0 110.107 -173.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -142.49 153.26 43.49 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -81.55 -5.54 58.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.857 1.663 . . . . 0.0 112.882 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.1 t -165.14 121.22 1.41 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.633 1.973 . . . . 0.0 110.569 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.0 ttp-105 -66.44 104.52 1.26 Allowed 'General case' 0 N--CA 1.473 0.711 0 O-C-N 120.488 -1.383 . . . . 0.0 110.8 174.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -113.97 2.79 15.13 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.219 1.408 . . . . 0.0 113.455 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.7 p -74.7 146.03 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.115 0.966 . . . . 0.0 112.235 178.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -130.4 7.36 4.93 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.891 1.676 . . . . 0.0 112.742 171.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.6 m 52.26 42.99 31.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.602 2.361 . . . . 0.0 113.023 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -155.77 -25.61 0.11 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.405 2.282 . . . . 0.0 113.349 -178.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -106.32 -4.21 20.29 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.058 1.343 . . . . 0.0 113.94 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 pt -60.33 -12.29 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.006 1.322 . . . . 0.0 113.885 -179.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -24.23 28.36 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 167.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 69.8 m -91.29 -5.37 54.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.363 1.465 . . . . 0.0 114.356 174.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.4 p -103.43 -176.7 3.16 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.497 1.519 . . . . 0.0 111.927 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -64.98 -19.49 66.01 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.173 -0.954 . . . . 0.0 113.465 171.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -93.64 20.12 7.82 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.008 2.123 . . . . 0.0 113.471 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -63.94 -9.26 14.52 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.022 2.129 . . . . 0.0 114.61 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -63.55 -2.33 1.59 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.853 2.461 . . . . 0.0 115.342 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 57.82 21.03 7.08 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.149 1.78 . . . . 0.0 114.755 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.67 157.81 11.21 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.79 2.036 . . . . 0.0 114.485 -173.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.02 -39.46 78.4 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.081 1.752 . . . . 0.0 114.694 -168.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -159.4 157.49 30.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.161 1.384 . . . . 0.0 112.525 167.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -135.1 128.67 32.63 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.339 1.056 . . . . 0.0 110.532 167.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.1 m -88.77 99.12 12.11 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.989 0.916 . . . . 0.0 109.659 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -82.5 135.05 35.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.321 -0.862 . . . . 0.0 112.337 174.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 66.4 mt -107.73 111.17 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 125.702 1.601 . . . . 0.0 107.676 174.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.98 86.67 7.35 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.56 -0.713 . . . . 0.0 109.845 169.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 t -152.32 175.0 13.13 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.244 1.018 . . . . 0.0 113.338 168.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -74.61 162.68 72.62 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 128.03 2.532 . . . . 0.0 110.678 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.43 -24.94 18.7 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 122.267 1.978 . . . . 0.0 114.02 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.82 -55.53 37.36 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.397 1.079 . . . . 0.0 113.07 -176.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.26 -1.26 7.75 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.829 2.353 . . . . 0.0 114.724 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.7 t -99.89 -54.61 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.152 1.781 . . . . 0.0 109.6 174.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.41 ' HE3' ' NE1' ' A' ' 51' ' ' TRP . 0.0 OUTLIER -66.54 -46.06 77.39 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.217 -0.927 . . . . 0.0 112.983 -179.184 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.56 -2.99 31.69 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -171.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.0 mt -53.25 -35.89 24.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.793 0.837 . . . . 0.0 110.599 169.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -110.34 158.97 17.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 0.0 113.204 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -156.41 104.34 2.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.18 1.792 . . . . 0.0 109.932 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.92 3.15 85.81 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 124.465 1.031 . . . . 0.0 114.949 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.0 mt -74.82 115.48 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.542 1.171 . . . . 0.0 111.238 -177.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -108.81 -13.1 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 126.383 1.873 . . . . 0.0 110.962 171.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.06 4.1 3.82 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.517 2.327 . . . . 0.0 116.262 -170.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.4 t 53.14 64.4 1.87 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.619 1.568 . . . . 0.0 112.804 -173.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -155.49 158.23 38.19 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.399 1.88 . . . . 0.0 111.091 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -141.52 -167.97 2.54 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.659 -1.275 . . . . 0.0 111.721 164.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.59 146.18 31.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 125.579 1.552 . . . . 0.0 109.603 167.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.6 tp -51.41 142.72 13.06 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.891 1.276 . . . . 0.0 112.002 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.73 173.09 1.86 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -122.99 -23.89 4.88 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.092 1.357 . . . . 0.0 113.943 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.8 m -81.42 171.07 15.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.778 1.231 . . . . 0.0 111.947 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.76 106.65 13.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.778 1.231 . . . . 0.0 111.676 -176.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -101.28 162.73 12.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.036 1.735 . . . . 0.0 110.877 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -73.3 105.64 4.79 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.694 -0.629 . . . . 0.0 110.382 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.96 122.63 38.98 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.068 1.347 . . . . 0.0 111.466 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 32.8 t -124.72 91.42 3.44 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.997 1.319 . . . . 0.0 110.726 -173.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -83.98 161.8 20.64 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.601 0.76 . . . . 0.0 111.693 171.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.76 109.78 3.7 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.115 0.966 . . . . 0.0 110.669 163.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.53 130.91 43.6 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.515 1.126 . . . . 0.0 110.828 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.4 t -57.74 150.38 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.321 1.448 . . . . 0.0 112.137 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 68.1 p -123.97 101.19 7.11 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.622 1.569 . . . . 0.0 111.453 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 55.2 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 128.078 2.551 . . . . 0.0 114.512 178.719 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.406 ' HA ' ' O ' ' A' ' 68' ' ' ASP . 91.5 mtt180 . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.61 -42.17 0.29 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.138 1.892 . . . . 0.0 113.488 -166.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.28 176.82 9.26 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.59 2.356 . . . . 0.0 109.6 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.462 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 11.4 mmpt? -115.28 131.98 56.76 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.982 1.313 . . . . 0.0 110.702 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -136.2 160.67 37.99 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.531 . . . . 0.0 112.151 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -92.2 155.83 17.73 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.631 1.972 . . . . 0.0 112.145 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 107.71 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.652 1.581 . . . . 0.0 111.395 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.1 tptt -136.56 114.73 11.57 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.686 1.595 . . . . 0.0 111.069 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -133.34 132.09 40.88 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.989 1.716 . . . . 0.0 110.609 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 66.1 m -144.87 178.48 7.98 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.523 1.929 . . . . 0.0 111.595 -172.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 m -147.01 102.11 3.48 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.588 -1.32 . . . . 0.0 110.871 178.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -163.35 173.7 12.91 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.47 1.108 . . . . 0.0 113.652 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 168.31 5.19 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 128.133 2.573 . . . . 0.0 113.433 172.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.3 p90 -139.77 140.37 36.68 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.707 1.603 . . . . 0.0 111.868 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.6 t -98.72 143.11 29.44 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.204 1.002 . . . . 0.0 111.487 174.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.5 m -147.22 -178.6 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 126.565 1.946 . . . . 0.0 111.193 -176.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.2 m -127.35 119.53 26.45 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.333 -0.854 . . . . 0.0 111.307 174.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.67 133.59 33.68 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.552 0.741 . . . . 0.0 111.248 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -138.73 114.33 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.337 1.455 . . . . 0.0 108.472 175.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 58.27 56.44 4.48 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.0 1.32 . . . . 0.0 112.489 -170.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.01 25.02 12.65 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.492 2.317 . . . . 0.0 115.091 169.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.39 132.57 5.55 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.921 1.288 . . . . 0.0 109.553 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -76.26 105.52 2.09 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.812 3.008 . . . . 0.0 112.147 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 8.5 m -101.02 15.14 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.106 1.363 . . . . 0.0 111.956 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.7 t-80 -157.47 139.82 14.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.877 1.217 . . . . 0.0 112.741 -169.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -96.75 140.58 31.12 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.721 0.808 . . . . 0.0 111.306 173.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 92.1 t -109.8 -58.06 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.073 0.949 . . . . 0.0 111.598 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.08 -173.45 45.6 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 118.648 0.658 . . . . 0.0 113.191 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.4 p -115.46 138.76 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.295 1.038 . . . . 0.0 110.981 178.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 60.46 4.69 4.1 Favored Glycine 0 CA--C 1.544 1.895 0 N-CA-C 116.992 1.557 . . . . 0.0 116.992 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -167.41 158.93 11.99 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.213 2.205 . . . . 0.0 110.749 -174.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.2 m -110.93 101.62 10.18 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.004 1.721 . . . . 0.0 111.042 172.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.07 159.13 50.29 Favored Glycine 0 CA--C 1.538 1.505 0 C-N-CA 123.333 0.492 . . . . 0.0 112.732 171.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.0 t -151.61 173.46 14.62 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.288 1.435 . . . . 0.0 111.772 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -157.41 173.59 34.87 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.739 1.638 . . . . 0.0 113.371 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -125.09 20.79 6.63 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 125.912 1.72 . . . . 0.0 114.601 -175.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.5 m -128.17 162.4 27.04 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.908 1.683 . . . . 0.0 112.5 -172.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.1 26.89 2.07 Favored Glycine 0 CA--C 1.539 1.566 0 C-N-CA 126.123 1.821 . . . . 0.0 115.961 -175.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 70.3 mt -65.81 138.84 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 126.042 1.737 . . . . 0.0 110.496 -177.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -145.04 18.94 1.6 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.988 1.315 . . . . 0.0 113.758 -174.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -67.02 -25.26 66.19 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.534 -1.353 . . . . 0.0 113.75 -176.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -64.77 167.99 6.77 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.457 1.903 . . . . 0.0 113.58 170.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.4 m -60.0 -33.09 71.52 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.986 -1.071 . . . . 0.0 112.88 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 5.0 t 44.19 63.44 1.63 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.027 2.131 . . . . 0.0 113.531 -176.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.9 mp -57.44 -15.66 7.38 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.495 1.118 . . . . 0.0 114.006 178.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.7 m -57.29 -23.14 46.55 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 126.258 1.823 . . . . 0.0 114.454 170.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.68 107.66 6.7 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.403 1.481 . . . . 0.0 111.185 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.87 -1.8 55.39 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.196 1.379 . . . . 0.0 115.069 -178.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.8 m -137.14 -167.6 2.13 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.444 1.498 . . . . 0.0 111.106 174.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -155.87 172.94 17.5 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.97 1.708 . . . . 0.0 109.421 -177.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.1 t-105 -55.31 -37.74 67.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.51 1.924 . . . . 0.0 112.139 170.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -37.6 78.17 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.775 1.23 . . . . 0.0 112.187 -179.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -92.81 -25.2 18.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.778 1.231 . . . . 0.0 113.587 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -52.65 -41.62 63.94 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.531 1.532 . . . . 0.0 113.15 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -56.83 -61.54 2.36 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.081 0.953 . . . . 0.0 110.588 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -56.5 -26.35 54.15 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -65.73 -48.42 71.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.284 1.434 . . . . 0.0 112.863 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -153.16 24.51 0.55 Allowed 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.277 1.584 . . . . 0.0 115.277 -176.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -129.66 145.1 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.527 -1.358 . . . . 0.0 109.538 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.3 t -145.21 158.67 43.77 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -90.72 3.44 54.28 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.487 1.915 . . . . 0.0 112.679 167.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.1 t -164.44 113.84 1.17 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.506 1.922 . . . . 0.0 111.3 174.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -66.57 104.25 1.24 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.606 -1.309 . . . . 0.0 110.628 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -115.58 4.3 14.14 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.537 1.535 . . . . 0.0 113.374 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.0 p -72.68 145.21 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.891 1.276 . . . . 0.0 112.721 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -132.47 5.66 4.06 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.17 1.788 . . . . 0.0 113.106 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 34.6 m 52.64 39.72 28.8 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.521 2.328 . . . . 0.0 114.378 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.406 ' O ' ' HA ' ' A' ' 1' ' ' ARG . 0.8 OUTLIER -153.87 -27.35 0.13 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 128.34 2.656 . . . . 0.0 112.213 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -109.1 2.36 21.08 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.709 1.603 . . . . 0.0 113.695 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -61.58 -12.66 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.171 1.388 . . . . 0.0 113.6 177.061 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -52.44 -34.15 47.46 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.641 1.176 . . . . 0.0 112.879 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.3 t -80.7 2.3 26.53 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.119 1.368 . . . . 0.0 114.218 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.1 p -121.19 -177.45 3.52 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.967 1.707 . . . . 0.0 111.845 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -62.51 -19.66 63.83 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 172.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.73 7.31 24.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.315 1.846 . . . . 0.0 114.558 -171.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -64.07 -5.57 4.94 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.968 2.107 . . . . 0.0 114.904 -176.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -61.92 -5.45 2.12 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.435 1.894 . . . . 0.0 114.681 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.6 t 53.0 35.61 19.88 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.301 2.241 . . . . 0.0 114.847 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 160.57 17.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.868 1.667 . . . . 0.0 113.063 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -68.34 -27.32 66.16 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.059 1.744 . . . . 0.0 115.253 -171.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -162.72 159.04 23.8 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.425 1.49 . . . . 0.0 112.404 166.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -134.19 141.78 47.18 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.3 1.04 . . . . 0.0 110.557 168.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.2 m -108.2 94.12 4.9 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.978 1.311 . . . . 0.0 109.532 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -78.98 136.09 37.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.78 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 88.8 mt -113.26 115.65 50.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 126.077 1.751 . . . . 0.0 108.271 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -85.15 86.41 7.38 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.775 -0.578 . . . . 0.0 110.327 168.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.4 m -142.09 155.04 45.35 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.193 1.397 . . . . 0.0 112.748 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.1 mtp180 -70.36 161.78 74.16 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.239 1.016 . . . . 0.0 110.174 162.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.79 -22.33 37.02 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.764 1.643 . . . . 0.0 114.632 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.26 -58.19 20.6 Favored Pre-proline 0 N--CA 1.474 0.763 0 CA-C-N 119.691 1.132 . . . . 0.0 113.185 -177.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.21 0.5 5.14 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.339 2.692 . . . . 0.0 114.858 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.9 t -102.97 -55.07 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 126.515 1.926 . . . . 0.0 109.712 176.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.0 -44.86 79.27 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.27 -0.894 . . . . 0.0 112.819 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.7 -3.08 32.73 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -173.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.9 mt -53.45 -35.81 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 123.52 0.728 . . . . 0.0 110.473 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.2 p -109.29 158.94 17.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.461 1.104 . . . . 0.0 113.236 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -155.43 106.04 2.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.169 1.788 . . . . 0.0 109.961 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 4.09 87.57 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.483 1.04 . . . . 0.0 114.886 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.1 mt -75.73 115.15 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 118.5 1.15 . . . . 0.0 111.27 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.7 -11.89 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.628 1.971 . . . . 0.0 110.847 172.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 9.01 1.53 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.859 2.463 . . . . 0.0 116.1 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 83.0 p 49.27 63.76 2.02 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.757 1.623 . . . . 0.0 113.455 -172.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -154.61 155.71 35.2 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 126.715 2.006 . . . . 0.0 111.116 -176.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -141.9 -167.23 2.4 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.722 -1.236 . . . . 0.0 111.475 162.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 19.2 t -127.41 143.59 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.762 1.625 . . . . 0.0 108.711 170.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -50.05 141.25 11.2 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.567 1.147 . . . . 0.0 111.968 168.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 173.2 1.28 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 172.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -119.88 -32.74 4.16 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.75 1.22 . . . . 0.0 113.406 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.8 m -74.84 172.11 12.79 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.506 1.522 . . . . 0.0 112.168 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -121.21 116.63 25.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.583 1.153 . . . . 0.0 110.923 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -113.54 157.25 22.28 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.913 1.685 . . . . 0.0 109.805 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.63 112.45 4.17 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.398 0.545 . . . . 0.0 110.106 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.96 123.07 48.83 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.372 1.469 . . . . 0.0 110.843 -170.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 28.3 t -129.46 97.42 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.63 1.172 . . . . 0.0 109.924 -167.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -87.73 159.75 18.36 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.742 0.817 . . . . 0.0 110.779 171.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -145.08 128.09 16.52 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.963 0.905 . . . . 0.0 108.769 158.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -116.39 127.66 54.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.014 1.326 . . . . 0.0 109.849 -175.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 36.7 t -59.14 145.22 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-O 121.263 0.554 . . . . 0.0 112.111 -176.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.7 t -132.93 103.15 5.92 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.225 1.81 . . . . 0.0 110.955 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 99.2 p . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.601 1.56 . . . . 0.0 114.702 -179.481 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.2 ptp85 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.87 -54.65 0.32 Allowed 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 121.994 1.796 . . . . 0.0 112.039 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 m -140.08 171.27 14.41 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.959 1.703 . . . . 0.0 110.477 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -92.35 130.65 37.98 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.114 1.366 . . . . 0.0 110.252 -178.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -137.54 161.04 37.46 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.412 1.085 . . . . 0.0 112.85 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -95.41 160.01 14.73 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.491 2.317 . . . . 0.0 111.665 178.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.47 106.16 18.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.957 1.703 . . . . 0.0 110.933 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -134.48 118.42 17.32 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.994 1.718 . . . . 0.0 111.377 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -125.64 152.92 44.55 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.117 1.367 . . . . 0.0 111.464 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 19.6 t -154.51 175.49 13.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.367 1.467 . . . . 0.0 111.42 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -144.88 101.65 3.67 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.956 -1.09 . . . . 0.0 110.441 173.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.72 178.64 7.72 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.082 1.353 . . . . 0.0 113.442 -178.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 170.78 9.16 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 128.053 2.541 . . . . 0.0 113.661 174.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -141.69 141.13 33.33 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.067 1.747 . . . . 0.0 112.065 -176.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.6 t -101.21 140.54 35.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.817 0.847 . . . . 0.0 111.793 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.5 m -146.58 -179.41 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 126.452 1.901 . . . . 0.0 111.251 -176.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.2 m -125.96 116.27 21.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.815 1.246 . . . . 0.0 111.04 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 m -85.29 132.32 34.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.594 0.634 . . . . 0.0 111.289 173.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -136.72 116.28 12.88 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 125.188 1.395 . . . . 0.0 108.323 174.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 57.87 55.98 5.04 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.86 1.264 . . . . 0.0 112.38 -170.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.33 25.18 12.13 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 127.439 2.295 . . . . 0.0 115.072 169.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.09 132.71 5.33 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.844 1.257 . . . . 0.0 109.787 -174.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.99 106.71 2.3 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 124.008 3.139 . . . . 0.0 113.5 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.3 m -108.65 14.95 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.888 2.075 . . . . 0.0 112.619 -178.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -151.66 143.91 24.02 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.612 -1.305 . . . . 0.0 111.672 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -100.63 132.68 45.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 111.425 176.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.1 t -107.85 -53.52 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.908 0.883 . . . . 0.0 111.982 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.64 -172.5 44.28 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-N 118.93 0.786 . . . . 0.0 114.504 -173.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -126.18 128.88 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.479 1.511 . . . . 0.0 109.722 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.58 2.92 8.3 Favored Glycine 0 CA--C 1.539 1.555 0 N-CA-C 116.354 1.302 . . . . 0.0 116.354 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -168.88 163.39 11.61 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 128.555 2.742 . . . . 0.0 110.232 -176.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.1 m -108.48 120.55 42.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.733 1.613 . . . . 0.0 109.848 170.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.88 148.91 51.61 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 123.621 0.629 . . . . 0.0 112.765 174.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.6 t -70.98 155.98 40.17 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.961 0.905 . . . . 0.0 112.467 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -80.84 -176.08 50.28 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.07 1.319 . . . . 0.0 113.217 170.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 83.51 32.17 25.61 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 123.94 0.781 . . . . 0.0 115.014 174.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.4 p -112.72 160.1 18.28 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.954 1.702 . . . . 0.0 113.086 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.67 3.48 61.03 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 125.42 1.486 . . . . 0.0 115.269 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 45.4 mt -63.63 136.72 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.728 1.611 . . . . 0.0 110.629 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -145.92 18.56 1.44 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.37 1.468 . . . . 0.0 113.38 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -88.19 -11.72 45.94 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 120.795 -1.191 . . . . 0.0 112.406 -173.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -72.44 168.71 17.91 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.276 1.831 . . . . 0.0 113.324 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.3 m -68.6 -33.26 73.74 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.67 0.788 . . . . 0.0 112.451 176.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.2 t 44.95 72.2 0.22 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 127.075 2.15 . . . . 0.0 113.759 -176.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mp -68.44 -0.29 4.79 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.236 1.414 . . . . 0.0 114.611 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 73.0 m -60.99 -33.2 72.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.723 1.609 . . . . 0.0 115.013 177.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.4 113.22 10.98 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.84 1.256 . . . . 0.0 110.712 -176.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.83 0.13 62.41 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 124.99 1.281 . . . . 0.0 114.741 -175.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.0 m -136.41 -168.95 2.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.705 1.602 . . . . 0.0 110.95 173.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -152.94 171.64 18.02 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.146 1.378 . . . . 0.0 110.363 -176.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 3.2 t-105 -55.37 -36.74 66.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.727 1.611 . . . . 0.0 111.406 167.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.81 -32.34 70.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.907 1.283 . . . . 0.0 112.465 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.1 p -97.94 -24.72 15.26 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.763 1.225 . . . . 0.0 113.737 175.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -52.85 -40.21 63.2 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.768 1.627 . . . . 0.0 112.992 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -58.08 -61.59 2.44 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.779 0.832 . . . . 0.0 111.196 172.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.93 -28.73 38.79 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 tmtm? -66.42 -44.84 81.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.676 1.59 . . . . 0.0 114.042 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -155.72 21.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.8 mt -127.59 146.52 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 120.145 -1.597 . . . . 0.0 109.412 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.45 154.64 43.15 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -88.89 2.1 54.3 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.949 1.7 . . . . 0.0 112.343 168.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.83 106.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.387 1.875 . . . . 0.0 111.409 174.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 ttp-105 -67.23 114.73 6.2 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.494 -1.379 . . . . 0.0 110.178 171.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -126.98 5.26 6.52 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.255 1.422 . . . . 0.0 113.293 176.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.9 p -71.37 150.3 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.24 1.416 . . . . 0.0 113.125 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -132.62 3.3 3.84 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.012 1.725 . . . . 0.0 112.877 173.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . 0.251 90.2 m 45.65 57.66 4.84 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.743 2.417 . . . . 0.0 112.083 -171.606 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -156.34 -43.69 0.07 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.585 2.354 . . . . 0.0 111.736 -163.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -113.47 0.02 14.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.714 2.005 . . . . 0.0 113.573 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.2 pt -60.65 -11.03 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.21 1.404 . . . . 0.0 113.966 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -25.76 29.21 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 167.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 t -89.4 -2.54 58.44 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.557 1.543 . . . . 0.0 113.794 176.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 p -108.82 -179.52 3.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.904 1.682 . . . . 0.0 111.51 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -69.45 -14.58 62.96 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 172.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -81.63 6.43 15.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.348 1.859 . . . . 0.0 114.743 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -65.23 -5.03 5.98 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 128.413 2.685 . . . . 0.0 115.237 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -62.56 -2.32 1.06 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.676 1.99 . . . . 0.0 115.25 -173.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 8.5 t 56.14 31.9 19.13 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.169 1.788 . . . . 0.0 113.263 -173.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.36 154.46 20.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.482 1.113 . . . . 0.0 112.03 176.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -63.64 -33.61 76.0 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.007 1.323 . . . . 0.0 113.692 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -164.43 160.21 20.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.097 1.759 . . . . 0.0 112.123 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t30 -138.26 123.62 19.42 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.227 1.011 . . . . 0.0 110.422 172.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 42.0 m -87.37 94.74 9.77 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.842 0.857 . . . . 0.0 109.428 173.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -78.75 132.85 37.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.002 -0.436 . . . . 0.0 111.1 172.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.1 mt -111.8 113.44 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.55 1.54 . . . . 0.0 107.966 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -85.82 84.39 7.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.89 -0.506 . . . . 0.0 110.522 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.0 m -141.2 159.03 43.07 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.998 1.319 . . . . 0.0 113.249 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -71.41 162.71 71.29 Favored Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 124.739 1.216 . . . . 0.0 111.363 162.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.22 -23.73 28.38 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.556 2.171 . . . . 0.0 114.355 176.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -60.86 -58.23 20.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-N 119.68 1.127 . . . . 0.0 112.884 -177.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.89 0.89 5.08 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.034 2.489 . . . . 0.0 114.93 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.54 -57.4 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 126.937 2.095 . . . . 0.0 110.156 177.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -40.03 79.67 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.335 -0.853 . . . . 0.0 112.708 -177.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.81 -3.5 44.82 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 62.2 mt -52.84 -36.36 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.777 0.717 . . . . 0.0 110.529 169.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.63 159.58 16.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.3 1.04 . . . . 0.0 113.081 174.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -156.0 104.99 2.32 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.535 1.534 . . . . 0.0 110.646 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.63 5.1 87.03 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.299 0.952 . . . . 0.0 114.99 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.7 mt -75.28 115.87 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.534 1.167 . . . . 0.0 111.155 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.2 mt -111.54 -11.92 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 126.629 1.972 . . . . 0.0 110.946 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 4.3 5.09 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.438 2.295 . . . . 0.0 116.007 -171.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 51.81 68.28 0.83 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.805 1.642 . . . . 0.0 113.041 -170.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -156.48 163.57 39.25 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.133 1.773 . . . . 0.0 111.018 176.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -143.52 -165.37 2.08 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.884 -1.135 . . . . 0.0 111.338 163.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.21 146.83 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 125.448 1.499 . . . . 0.0 109.285 165.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.0 tp -50.96 142.11 12.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.623 1.169 . . . . 0.0 111.409 167.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.19 174.32 0.94 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 171.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -117.19 -32.55 4.96 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.769 1.228 . . . . 0.0 113.529 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -78.76 176.01 9.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.519 1.927 . . . . 0.0 112.325 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -121.81 111.03 16.63 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.099 -1.001 . . . . 0.0 111.49 -177.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -107.95 160.33 15.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.203 1.801 . . . . 0.0 109.935 -174.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -70.91 110.78 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.687 -0.633 . . . . 0.0 110.845 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.16 126.87 50.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.813 1.645 . . . . 0.0 110.981 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.3 t -132.23 96.9 3.98 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.686 1.194 . . . . 0.0 109.961 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -103.6 135.66 44.76 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.157 1.383 . . . . 0.0 110.16 -178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 22.1 m -116.83 146.25 43.01 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.936 -1.102 . . . . 0.0 108.646 168.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -134.94 124.42 24.89 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.035 0.934 . . . . 0.0 109.344 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.3 t -58.01 147.37 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.015 0.926 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.7 t -136.45 86.11 2.2 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 122.782 1.277 . . . . 0.0 112.836 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 61.3 m . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.198 1.799 . . . . 0.0 112.784 173.739 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -74.94 -52.11 0.11 Allowed 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.411 2.074 . . . . 0.0 112.784 -169.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 85.9 m -140.4 168.27 20.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.575 2.35 . . . . 0.0 109.599 176.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -93.45 140.44 29.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.324 1.05 . . . . 0.0 110.22 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -137.64 160.86 38.02 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.699 1.2 . . . . 0.0 112.46 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -94.46 153.74 17.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.741 2.016 . . . . 0.0 112.01 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.18 103.59 16.25 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.381 1.473 . . . . 0.0 111.22 -174.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -133.64 118.83 18.64 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.143 1.377 . . . . 0.0 111.456 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -129.51 152.22 49.29 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.04 1.736 . . . . 0.0 110.942 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.8 m -155.23 175.11 14.28 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.92 1.688 . . . . 0.0 111.43 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -144.71 104.77 4.06 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.936 -1.103 . . . . 0.0 110.838 175.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.77 172.17 6.91 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.916 1.286 . . . . 0.0 113.405 -171.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 172.86 1.09 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 128.329 2.652 . . . . 0.0 114.224 168.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -141.17 143.01 33.98 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.639 1.975 . . . . 0.0 111.7 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.4 t -103.49 138.85 39.63 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.069 0.947 . . . . 0.0 111.097 176.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.5 m -145.45 -179.49 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 125.905 1.682 . . . . 0.0 111.435 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.6 m -126.22 117.44 23.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.608 1.163 . . . . 0.0 111.527 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.87 130.08 34.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.832 0.853 . . . . 0.0 111.201 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -138.95 112.6 8.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.064 1.346 . . . . 0.0 108.925 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 58.82 58.51 3.21 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.154 1.382 . . . . 0.0 112.331 -172.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 62.84 27.64 16.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 127.27 2.228 . . . . 0.0 114.841 171.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.75 133.51 5.49 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.983 1.313 . . . . 0.0 109.767 -176.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 101.04 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 124.149 3.232 . . . . 0.0 112.308 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 m -96.21 1.26 10.38 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 C-N-CA 125.11 1.364 . . . . 0.0 112.447 -178.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -143.82 139.83 29.53 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 121.357 1.89 . . . . 0.0 110.997 -171.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -88.38 145.38 25.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.155 0.582 . . . . 0.0 110.294 172.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 73.6 t -114.43 -57.37 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.735 0.814 . . . . 0.0 111.426 173.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.09 -174.79 43.83 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 123.981 0.8 . . . . 0.0 112.509 -172.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.73 132.61 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.588 0.755 . . . . 0.0 112.118 -173.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.08 0.19 14.04 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 115.287 0.875 . . . . 0.0 115.287 -173.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 96.2 p -173.81 167.83 4.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.684 2.794 . . . . 0.0 110.321 -172.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.1 m -104.78 113.84 27.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.122 1.369 . . . . 0.0 110.707 172.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -82.74 74.93 2.44 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 125.228 1.394 . . . . 0.0 112.879 -177.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.5 t -65.34 163.82 14.81 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.327 1.051 . . . . 0.0 112.847 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.16 169.45 15.93 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.528 2.013 . . . . 0.0 113.823 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -90.45 73.54 1.86 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.241 1.4 . . . . 0.0 112.933 -176.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.6 p -63.45 158.34 21.01 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 176.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -116.6 22.12 11.09 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 125.886 1.708 . . . . 0.0 114.328 -175.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 60.9 mt -64.37 135.07 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 125.48 1.512 . . . . 0.0 110.264 -174.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -131.56 -1.26 3.89 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.136 1.774 . . . . 0.0 113.221 -178.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.31 -31.48 72.71 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.234 1.814 . . . . 0.0 112.326 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -144.68 161.93 37.95 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.998 2.119 . . . . 0.0 112.032 178.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 27.0 m -70.78 -24.07 62.52 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.827 1.651 . . . . 0.0 112.08 167.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.0 t 52.34 29.48 6.87 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.612 1.965 . . . . 0.0 113.519 -172.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.6 mp 53.13 85.98 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.876 2.471 . . . . 0.0 112.616 -176.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.6 t -121.79 -55.05 1.92 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.498 1.519 . . . . 0.0 113.183 -176.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -118.33 119.3 34.23 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.291 1.436 . . . . 0.0 111.579 -176.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.38 6.63 70.62 Favored Glycine 0 CA--C 1.538 1.494 0 C-N-CA 124.742 1.163 . . . . 0.0 115.253 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.7 p -88.44 175.94 7.39 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.226 2.21 . . . . 0.0 112.165 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -153.26 158.2 41.31 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 123.259 1.504 . . . . 0.0 113.429 176.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.2 t-105 -55.97 -33.61 64.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.066 1.746 . . . . 0.0 112.863 171.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -44.52 92.71 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.09 -1.006 . . . . 0.0 111.039 -178.65 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.8 p -81.49 -24.7 36.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.503 1.521 . . . . 0.0 114.563 173.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -51.3 -43.59 61.71 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.211 1.404 . . . . 0.0 112.126 174.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -57.89 -63.08 1.37 Allowed 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 124.596 1.158 . . . . 0.0 110.922 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -21.52 53.29 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -65.98 -48.74 70.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.354 1.461 . . . . 0.0 114.431 174.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -152.36 19.96 0.64 Allowed 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.1 mt -125.63 149.98 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.768 1.627 . . . . 0.0 108.527 177.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -144.51 156.86 44.37 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.453 0.644 . . . . 0.0 112.532 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -93.0 4.35 54.16 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.716 1.606 . . . . 0.0 112.16 169.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 t -160.73 111.76 1.83 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.647 1.979 . . . . 0.0 111.015 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.0 ttp85 -67.08 101.72 0.91 Allowed 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.564 -1.335 . . . . 0.0 110.557 172.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -113.85 4.42 15.87 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.654 1.582 . . . . 0.0 113.2 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.5 p -72.43 141.67 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.682 1.193 . . . . 0.0 112.427 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -128.7 7.94 5.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.476 1.91 . . . . 0.0 112.698 172.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.5 m 49.87 47.12 23.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.054 2.542 . . . . 0.0 113.685 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -163.0 -28.46 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.029 2.531 . . . . 0.0 111.86 179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -105.93 0.7 26.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.465 1.506 . . . . 0.0 113.853 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 pt -60.94 -11.69 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.035 1.334 . . . . 0.0 113.686 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -23.69 28.85 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.3 p -96.11 -4.9 41.99 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.5 p -97.04 -176.01 3.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.824 1.65 . . . . 0.0 111.476 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -64.75 -18.02 64.67 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 170.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -92.7 11.79 25.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.99 1.716 . . . . 0.0 114.145 -169.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -63.57 -8.46 9.78 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.823 2.449 . . . . 0.0 115.229 -175.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -62.75 -7.44 4.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.504 1.921 . . . . 0.0 114.71 -173.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.2 t 38.38 61.24 1.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.947 2.099 . . . . 0.0 113.653 -166.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 161.23 26.98 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.881 1.273 . . . . 0.0 112.11 160.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.25 -32.25 73.55 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.512 1.525 . . . . 0.0 114.525 -172.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -161.84 160.2 27.83 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 169.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -135.03 118.69 17.06 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.836 0.854 . . . . 0.0 110.888 171.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 25.8 m -81.84 95.55 7.35 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.036 0.534 . . . . 0.0 109.708 172.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 -80.94 131.05 35.31 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.811 -0.556 . . . . 0.0 111.892 175.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.2 mt -106.76 115.24 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 125.38 1.472 . . . . 0.0 107.779 173.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -88.21 92.53 9.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.044 0.449 . . . . 0.0 109.89 167.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.2 t -147.44 -173.7 4.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.635 1.174 . . . . 0.0 112.999 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -99.91 162.53 20.75 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 128.368 2.667 . . . . 0.0 110.995 172.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.0 -25.23 23.11 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.431 2.087 . . . . 0.0 114.244 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -58.41 18.36 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.036 -177.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -69.3 0.35 5.42 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.336 2.69 . . . . 0.0 114.831 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.5 t -102.33 -58.66 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.85 2.06 . . . . 0.0 110.001 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.27 -38.86 82.17 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.319 -0.863 . . . . 0.0 112.777 -177.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.99 -4.49 47.29 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.5 mt -53.23 -35.02 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.858 0.754 . . . . 0.0 110.798 170.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.7 p -113.24 158.08 20.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.005 1.322 . . . . 0.0 113.077 174.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -153.93 104.73 2.69 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.942 1.697 . . . . 0.0 110.373 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.84 4.97 88.41 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.206 0.908 . . . . 0.0 114.986 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.4 mt -76.35 118.82 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 118.607 1.203 . . . . 0.0 111.131 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 3.3 mt -115.69 -6.36 11.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 126.943 2.097 . . . . 0.0 110.829 173.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.04 7.93 4.41 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.383 2.273 . . . . 0.0 115.682 -172.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 85.2 p 50.43 61.48 3.18 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.867 1.667 . . . . 0.0 113.912 -174.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -157.58 154.17 28.07 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 126.284 1.833 . . . . 0.0 110.54 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -137.99 -169.81 2.64 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.095 -1.003 . . . . 0.0 111.63 166.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.4 p -122.63 144.38 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.671 1.588 . . . . 0.0 109.354 169.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.6 tp -52.51 141.79 19.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.526 1.131 . . . . 0.0 111.49 169.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.31 172.25 1.57 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 121.923 0.868 . . . . 0.0 113.265 172.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.3 t -117.67 -30.69 5.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.817 1.247 . . . . 0.0 113.263 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.6 m -78.85 170.72 16.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.464 1.506 . . . . 0.0 112.15 177.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -118.51 108.12 14.61 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.577 1.151 . . . . 0.0 111.063 -176.401 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -100.8 161.55 13.52 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.61 1.564 . . . . 0.0 110.324 -173.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -70.38 108.34 4.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.735 -0.603 . . . . 0.0 110.125 179.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.35 130.4 47.52 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 124.695 1.198 . . . . 0.0 111.888 -175.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.9 t -135.93 95.36 3.2 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.096 0.959 . . . . 0.0 110.85 -172.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -86.54 162.56 17.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.723 0.773 . . . . 0.0 111.162 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.72 135.15 16.08 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.482 1.113 . . . . 0.0 108.975 157.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -120.46 130.43 54.3 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.063 1.345 . . . . 0.0 110.442 -176.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.5 145.54 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 124.006 0.922 . . . . 0.0 111.925 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.8 t -135.41 78.21 1.71 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.681 1.192 . . . . 0.0 112.354 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.253 1.254 0 C-N-CA 126.185 1.794 . . . . 0.0 112.924 172.853 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -75.24 -40.37 0.86 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.068 1.846 . . . . 0.0 113.329 -176.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.38 179.67 6.65 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.224 2.209 . . . . 0.0 110.275 -176.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -109.87 127.52 54.76 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.237 1.415 . . . . 0.0 110.373 175.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -137.91 163.62 31.02 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.531 1.132 . . . . 0.0 113.36 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.1 mtpt -104.24 157.63 17.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.59 2.356 . . . . 0.0 111.626 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.58 113.7 25.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.385 1.874 . . . . 0.0 110.84 -177.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -136.13 102.63 5.07 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.842 1.257 . . . . 0.0 113.092 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -102.61 146.07 28.72 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.285 1.434 . . . . 0.0 111.368 173.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.1 m -145.69 169.69 17.97 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.227 1.811 . . . . 0.0 111.183 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.5 m -144.44 104.32 4.06 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 120.87 -1.144 . . . . 0.0 111.039 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.34 173.12 5.83 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.02 1.328 . . . . 0.0 113.163 -170.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.61 175.63 1.04 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.359 2.264 . . . . 0.0 114.315 169.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -143.66 144.76 32.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.221 1.809 . . . . 0.0 111.755 177.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.5 t -104.6 141.32 36.62 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.446 1.098 . . . . 0.0 110.847 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.6 m -148.24 -178.31 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.024 1.73 . . . . 0.0 111.738 -173.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -127.98 115.82 19.11 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.129 1.372 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.67 132.62 34.12 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.545 0.738 . . . . 0.0 111.857 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -135.85 117.2 14.64 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.441 1.496 . . . . 0.0 108.453 173.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 56.45 56.29 5.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.744 1.218 . . . . 0.0 112.357 -171.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 65.21 25.21 12.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 127.496 2.318 . . . . 0.0 115.038 169.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.93 132.34 5.21 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.784 1.234 . . . . 0.0 109.723 -174.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.71 109.81 2.97 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.595 2.863 . . . . 0.0 113.468 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.2 m -108.84 17.19 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.606 1.963 . . . . 0.0 112.686 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -153.8 144.67 22.67 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.635 -1.29 . . . . 0.0 111.871 174.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -88.25 149.23 23.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.574 0.749 . . . . 0.0 110.056 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 81.9 t -124.5 -45.86 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.657 0.783 . . . . 0.0 112.515 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.29 -179.39 48.23 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 118.98 0.809 . . . . 0.0 114.12 -175.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 p -132.36 118.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.54 1.536 . . . . 0.0 110.704 -172.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.21 2.28 58.59 Favored Glycine 0 CA--C 1.541 1.694 0 C-N-CA 124.139 0.876 . . . . 0.0 114.909 -172.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 94.0 p -173.77 169.19 4.23 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.466 2.706 . . . . 0.0 110.097 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.7 m -104.23 143.6 32.73 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.888 1.275 . . . . 0.0 109.085 165.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.88 156.71 53.48 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.518 0.58 . . . . 0.0 112.287 171.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.2 t -70.18 156.38 39.31 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 122.042 -0.681 . . . . 0.0 112.061 177.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -89.81 174.37 40.91 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 124.83 1.205 . . . . 0.0 114.165 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 82.19 -0.91 88.3 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.148 1.356 . . . . 0.0 116.076 174.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.5 m -79.32 162.42 25.61 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.447 1.499 . . . . 0.0 113.099 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -109.16 15.9 32.91 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 125.881 1.705 . . . . 0.0 115.403 -176.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 56.8 mt -61.72 137.42 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.656 1.583 . . . . 0.0 111.264 -174.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -143.32 19.1 1.9 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.824 1.649 . . . . 0.0 113.136 -179.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 82.0 mt -80.97 -14.9 57.54 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.685 -1.259 . . . . 0.0 112.748 -175.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -85.99 173.35 9.98 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.214 1.806 . . . . 0.0 112.821 -178.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.1 m -59.81 -34.89 73.64 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.602 1.161 . . . . 0.0 112.492 173.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 4.1 t 44.39 73.15 0.16 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.751 2.42 . . . . 0.0 114.379 -177.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.9 mp -67.03 1.67 1.86 Allowed 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 126.457 1.903 . . . . 0.0 115.834 -174.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.8 m -61.6 -32.52 72.64 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.85 115.46 12.84 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.326 1.45 . . . . 0.0 110.342 -175.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.43 0.1 67.69 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.733 1.158 . . . . 0.0 114.739 -175.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.9 m -138.4 -174.5 3.83 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.227 1.411 . . . . 0.0 110.804 173.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -158.32 175.78 13.3 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.995 1.718 . . . . 0.0 110.855 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -60.05 -34.81 73.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.732 1.613 . . . . 0.0 113.075 177.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -44.38 96.62 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.578 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.0 p -79.54 -26.76 41.36 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -52.38 -43.23 64.61 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.858 1.663 . . . . 0.0 112.889 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -57.46 -61.45 2.48 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.409 1.084 . . . . 0.0 110.813 174.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.52 -26.95 56.22 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -49.75 68.74 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.313 1.445 . . . . 0.0 114.441 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -149.57 20.57 0.92 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -174.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -127.85 147.48 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.323 . . . . 0.0 109.566 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.12 154.58 43.33 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -87.63 0.68 55.32 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.05 1.74 . . . . 0.0 112.54 167.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.5 t -164.02 105.02 0.9 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.364 1.866 . . . . 0.0 111.202 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.2 ttp85 -67.41 105.81 1.91 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.558 -1.339 . . . . 0.0 110.934 173.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -117.75 3.75 12.28 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.527 1.531 . . . . 0.0 113.116 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.9 t -79.01 143.27 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.799 1.24 . . . . 0.0 111.66 -175.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -131.96 6.42 4.28 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.746 1.619 . . . . 0.0 113.313 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.2 m 50.43 46.72 24.98 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.838 2.055 . . . . 0.0 113.751 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -152.34 -29.14 0.16 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 127.118 2.167 . . . . 0.0 113.049 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -105.05 -2.72 24.05 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.307 1.443 . . . . 0.0 113.733 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -60.26 -12.52 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.656 1.582 . . . . 0.0 114.304 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -32.34 56.16 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.911 0.884 . . . . 0.0 112.018 167.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.8 t -88.7 -6.44 57.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.781 1.632 . . . . 0.0 114.461 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.4 p -109.73 -174.52 2.52 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.209 1.403 . . . . 0.0 112.191 -176.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -62.04 -20.83 64.38 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 120.917 -1.115 . . . . 0.0 113.618 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -94.67 17.4 13.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.157 1.783 . . . . 0.0 113.509 -169.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -67.57 -8.44 34.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.479 2.312 . . . . 0.0 114.72 -172.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -62.15 -3.62 1.36 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.973 2.509 . . . . 0.0 115.312 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.5 t 52.33 34.23 14.48 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.254 2.222 . . . . 0.0 115.054 176.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.26 164.31 5.53 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.503 1.921 . . . . 0.0 113.453 171.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -62.99 -39.59 95.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.948 1.299 . . . . 0.0 113.979 -173.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -161.02 164.79 30.69 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.487 1.515 . . . . 0.0 112.631 171.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -131.4 147.19 52.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.276 1.03 . . . . 0.0 109.952 164.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 47.3 m -107.3 92.55 4.12 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.183 1.393 . . . . 0.0 109.436 176.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -80.16 124.83 29.13 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.695 0.798 . . . . 0.0 111.708 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.0 mt -99.68 117.55 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.769 1.628 . . . . 0.0 108.432 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -87.56 86.35 7.2 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.573 -0.704 . . . . 0.0 110.53 169.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.0 m -142.9 156.96 45.0 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.381 1.473 . . . . 0.0 112.965 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -71.47 162.94 70.09 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 124.699 1.199 . . . . 0.0 110.585 163.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.02 -23.39 29.65 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.076 1.851 . . . . 0.0 114.52 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -61.25 -57.64 24.34 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.059 -0.972 . . . . 0.0 113.036 -177.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.68 0.32 5.75 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.035 2.49 . . . . 0.0 114.949 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.8 t -102.78 -54.45 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.527 1.931 . . . . 0.0 109.813 176.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -45.6 76.86 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.214 -0.929 . . . . 0.0 112.712 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.96 -2.93 32.8 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 -172.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.34 -36.23 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.501 0.72 . . . . 0.0 110.376 169.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.09 158.24 17.58 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.218 1.007 . . . . 0.0 113.172 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -155.97 101.51 2.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.129 1.771 . . . . 0.0 109.992 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 2.98 79.86 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.58 1.086 . . . . 0.0 114.88 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.2 mt -73.52 116.07 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.615 1.207 . . . . 0.0 111.249 -178.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.4 mt -108.8 -13.11 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 110.874 171.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.67 5.64 2.99 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 127.623 2.369 . . . . 0.0 116.298 -169.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.9 t 52.08 64.34 1.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.446 1.499 . . . . 0.0 112.661 -172.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -155.02 160.43 41.05 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.992 1.717 . . . . 0.0 111.262 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -144.67 -166.73 2.47 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.682 -1.262 . . . . 0.0 111.509 163.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.62 148.68 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 125.654 1.582 . . . . 0.0 109.589 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.01 142.16 25.87 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 111.476 168.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.27 172.67 2.36 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 122.558 1.17 . . . . 0.0 113.46 171.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 18.1 p -115.89 -36.83 4.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.407 1.883 . . . . 0.0 112.93 -176.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.1 m -74.52 171.7 13.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.556 1.942 . . . . 0.0 112.708 177.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -119.54 105.01 10.81 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.588 1.155 . . . . 0.0 111.31 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -98.29 162.6 13.1 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.866 1.666 . . . . 0.0 110.309 -175.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -71.51 107.38 4.38 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.726 -0.609 . . . . 0.0 110.11 177.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -100.58 129.76 46.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.49 1.116 . . . . 0.0 111.53 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 29.5 t -130.28 94.11 3.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.436 1.494 . . . . 0.0 109.497 -172.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -87.95 164.23 15.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.398 1.094 . . . . 0.0 110.663 170.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 11.5 m -129.57 168.29 16.63 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.958 1.303 . . . . 0.0 109.096 153.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -144.43 124.21 13.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.168 -0.958 . . . . 0.0 109.632 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.6 p -55.07 146.15 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 123.916 0.887 . . . . 0.0 112.473 177.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -131.85 80.65 1.93 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.283 1.433 . . . . 0.0 111.003 174.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.2 m . . . . . 0 C--O 1.253 1.276 0 C-N-CA 127.266 2.226 . . . . 0.0 113.567 178.655 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 CA--C 1.539 0.744 0 N-CA-C 113.07 0.373 . . . . 0.0 113.07 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.26 178.21 7.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.417 1.887 . . . . 0.0 110.391 -176.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -105.64 126.81 52.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.641 1.177 . . . . 0.0 110.28 -178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -133.48 155.99 48.56 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.874 1.27 . . . . 0.0 111.694 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -100.67 153.63 19.27 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.865 1.666 . . . . 0.0 112.302 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.37 112.48 19.37 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.702 1.601 . . . . 0.0 111.788 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -132.34 119.54 20.86 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.851 1.66 . . . . 0.0 110.936 174.096 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -132.08 150.2 52.22 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.516 1.526 . . . . 0.0 110.895 171.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.9 t -149.93 174.92 12.15 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.163 1.385 . . . . 0.0 111.705 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -141.18 104.03 4.55 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.417 -0.802 . . . . 0.0 111.004 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.7 p30 -165.91 173.16 10.8 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.947 1.299 . . . . 0.0 113.038 -172.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.7 173.2 2.94 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.856 2.063 . . . . 0.0 113.427 169.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -143.15 155.88 44.66 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.402 1.881 . . . . 0.0 110.422 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.9 t -113.62 145.94 40.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.237 1.415 . . . . 0.0 111.778 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -148.67 -179.3 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 126.314 1.845 . . . . 0.0 111.774 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.9 m -124.85 119.15 28.02 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.273 1.429 . . . . 0.0 111.893 174.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.5 t -85.44 131.15 34.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.508 1.123 . . . . 0.0 111.5 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -139.53 112.53 8.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.489 1.116 . . . . 0.0 109.303 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 58.66 58.22 3.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.33 1.452 . . . . 0.0 112.421 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.44 25.55 13.35 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.583 2.353 . . . . 0.0 114.83 169.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.46 134.91 5.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.093 1.357 . . . . 0.0 109.701 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.29 111.06 3.19 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.696 2.931 . . . . 0.0 113.705 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.458 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.3 m -109.85 16.09 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 126.35 1.86 . . . . 0.0 112.761 -179.212 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -152.64 137.01 16.67 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.712 -1.242 . . . . 0.0 110.621 177.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -79.72 152.41 29.89 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 168.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.1 t -126.67 -47.53 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.594 0.758 . . . . 0.0 112.824 174.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.45 -174.69 46.89 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.474 1.034 . . . . 0.0 115.103 -175.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 41.3 t -125.75 121.25 59.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 109.799 -174.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 63.74 4.39 10.17 Favored Glycine 0 CA--C 1.542 1.768 0 N-CA-C 115.981 1.152 . . . . 0.0 115.981 -175.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -168.32 163.98 12.95 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.747 2.419 . . . . 0.0 110.54 -177.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.7 m . . . . . 0 CA--C 1.543 0.688 0 C-N-CA 126.05 1.74 . . . . 0.0 111.129 173.729 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 CA--C 1.542 0.665 0 CA-C-O 121.981 0.896 . . . . 0.0 109.64 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.458 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.5 t-105 -55.59 -37.22 67.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.826 1.65 . . . . 0.0 111.274 167.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -26.24 63.52 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.212 1.805 . . . . 0.0 113.123 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.8 p -107.8 -24.55 11.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.653 1.581 . . . . 0.0 113.815 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -50.19 -42.29 50.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.476 1.91 . . . . 0.0 112.666 171.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -56.22 -63.03 1.32 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.698 1.199 . . . . 0.0 110.785 173.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -58.87 -27.02 64.78 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -62.36 -54.12 45.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.667 1.187 . . . . 0.0 113.141 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.8 p80 -147.75 22.64 1.13 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -176.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -124.8 150.03 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.532 -1.355 . . . . 0.0 109.446 175.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.7 t -145.19 150.73 37.26 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -84.08 -1.14 54.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.572 1.549 . . . . 0.0 112.92 168.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -162.43 108.2 1.22 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.271 1.829 . . . . 0.0 111.312 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -68.35 108.84 3.38 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.219 -1.55 . . . . 0.0 110.806 172.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -114.45 5.78 15.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.646 1.578 . . . . 0.0 112.569 171.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -74.5 136.09 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.258 1.423 . . . . 0.0 111.562 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -125.56 3.83 7.59 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.054 1.741 . . . . 0.0 113.147 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 21.6 m 56.83 30.96 18.72 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.151 2.18 . . . . 0.0 114.651 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -146.09 -19.03 0.45 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.334 2.654 . . . . 0.0 112.929 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.31 -2.59 16.64 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.793 1.637 . . . . 0.0 113.478 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.5 pt -65.36 -4.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 125.505 1.522 . . . . 0.0 114.021 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 23.4 ptm -54.22 -28.01 38.21 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.524 1.129 . . . . 0.0 113.665 159.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.5 t -87.69 -26.94 22.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.444 1.497 . . . . 0.0 113.458 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.7 p -87.94 -178.55 6.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.866 1.266 . . . . 0.0 111.934 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -65.47 -16.0 63.21 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.932 -1.105 . . . . 0.0 113.634 176.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -90.75 19.07 5.75 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.485 1.914 . . . . 0.0 113.929 -173.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -67.47 -7.84 28.75 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.025 2.13 . . . . 0.0 114.348 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -61.99 -0.87 0.55 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 128.239 2.616 . . . . 0.0 115.882 -173.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 t 49.57 51.63 16.06 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.112 1.765 . . . . 0.0 113.182 -176.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 167.35 2.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.896 1.278 . . . . 0.0 112.52 170.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -76.78 -30.03 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.833 1.253 . . . . 0.0 112.622 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.31 169.32 17.64 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.711 2.004 . . . . 0.0 111.325 168.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -143.95 161.86 37.64 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.045 0.938 . . . . 0.0 110.396 159.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.6 m -124.01 92.3 3.64 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.153 1.381 . . . . 0.0 110.247 -177.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -78.6 121.51 24.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.248 1.019 . . . . 0.0 111.262 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.3 mt -94.43 116.05 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 124.759 1.224 . . . . 0.0 107.962 171.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -86.64 90.77 8.37 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.662 -0.649 . . . . 0.0 109.83 167.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 57.7 p -145.52 170.72 15.84 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.132 1.373 . . . . 0.0 112.494 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -78.25 163.46 61.97 Favored Pre-proline 0 N--CA 1.475 0.792 0 C-N-CA 124.367 1.067 . . . . 0.0 109.951 164.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.68 -24.44 18.42 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.167 1.912 . . . . 0.0 113.987 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.85 -55.39 46.16 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.328 -177.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.32 -1.73 8.61 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.097 2.531 . . . . 0.0 114.844 179.193 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 t -99.01 -54.69 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 126.212 1.805 . . . . 0.0 109.54 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.22 -45.59 80.18 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.766 0.827 . . . . 0.0 112.887 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.26 -3.72 38.05 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -171.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.0 mt -54.36 -35.46 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 123.456 0.703 . . . . 0.0 110.507 171.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 p -109.32 158.34 17.98 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.761 1.224 . . . . 0.0 113.17 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -155.92 108.44 2.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.941 1.696 . . . . 0.0 110.561 177.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.01 1.48 86.71 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 124.533 1.063 . . . . 0.0 114.977 -178.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -75.1 119.88 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.932 1.293 . . . . 0.0 111.298 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.16 -13.05 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 126.624 1.97 . . . . 0.0 110.993 173.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.86 3.68 4.97 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 127.428 2.291 . . . . 0.0 116.46 -168.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 54.08 64.55 1.79 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.469 1.507 . . . . 0.0 112.601 -172.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -158.66 152.04 22.91 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.601 1.96 . . . . 0.0 110.486 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -136.63 -169.32 2.43 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.906 -1.121 . . . . 0.0 110.835 163.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.3 p -122.71 150.82 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 125.314 1.446 . . . . 0.0 109.185 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.3 tp -50.91 138.91 18.18 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.841 0.856 . . . . 0.0 111.255 167.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.45 176.06 0.68 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.053 0.941 . . . . 0.0 111.679 173.267 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -117.65 -26.99 6.4 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.788 -1.195 . . . . 0.0 113.936 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -87.9 169.32 12.12 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.394 1.477 . . . . 0.0 112.38 -174.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -114.3 103.53 11.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.051 -1.031 . . . . 0.0 111.667 -174.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -98.96 158.42 15.66 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.172 1.789 . . . . 0.0 110.422 -176.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.93 106.54 3.68 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.763 -0.586 . . . . 0.0 110.549 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -95.56 123.2 38.99 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.202 1.001 . . . . 0.0 111.662 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.6 t -123.19 88.51 2.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.903 1.681 . . . . 0.0 110.927 -174.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -81.19 162.64 23.52 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.785 0.802 . . . . 0.0 111.693 168.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -152.26 127.87 10.09 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 125.104 1.362 . . . . 0.0 108.251 162.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -119.96 137.46 54.05 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.801 1.24 . . . . 0.0 110.001 -173.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.6 t -61.52 148.14 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-O 121.514 0.673 . . . . 0.0 112.365 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.9 t -137.18 94.39 2.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.081 1.352 . . . . 0.0 110.996 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.171 1.788 . . . . 0.0 112.506 178.558 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo . . . . . 0 CA--C 1.537 0.635 0 N-CA-C 113.107 0.387 . . . . 0.0 113.107 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.12 171.91 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.91 2.084 . . . . 0.0 109.619 -177.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -102.33 129.7 48.85 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.285 1.034 . . . . 0.0 110.31 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -133.31 156.26 47.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 111.871 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.97 151.98 20.72 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.074 1.35 . . . . 0.0 112.457 175.446 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -74.6 120.96 20.86 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.713 1.605 . . . . 0.0 111.805 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -142.24 116.12 9.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.927 1.691 . . . . 0.0 110.207 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -133.22 147.43 51.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.924 1.69 . . . . 0.0 111.002 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.7 t -154.51 175.23 13.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.544 1.538 . . . . 0.0 111.549 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -139.41 101.19 4.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.473 1.109 . . . . 0.0 110.318 171.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.02 179.54 7.91 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.592 1.157 . . . . 0.0 113.52 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.1 170.98 10.39 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 128.336 2.654 . . . . 0.0 113.732 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -142.35 141.3 32.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.06 1.744 . . . . 0.0 112.008 -176.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.6 t -102.09 142.66 33.0 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.038 0.923 . . . . 0.0 111.619 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.532 HG23 HD22 ' A' ' 104' ' ' ASN . 14.4 m -147.24 -178.7 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.559 1.944 . . . . 0.0 111.241 -175.159 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.0 m -125.72 117.71 24.05 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.177 -0.952 . . . . 0.0 111.525 174.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.09 131.51 34.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.783 0.833 . . . . 0.0 111.413 174.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -140.32 111.44 7.08 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.126 1.37 . . . . 0.0 108.562 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 59.9 56.79 3.33 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.409 1.484 . . . . 0.0 112.456 -169.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.41 24.66 13.24 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.723 2.409 . . . . 0.0 115.102 169.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.66 133.05 5.69 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 125.142 1.377 . . . . 0.0 109.445 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -76.42 105.55 2.1 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.874 3.05 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.429 HG12 ' N ' ' A' ' 51' ' ' TRP . 5.7 m -101.96 15.46 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.714 1.606 . . . . 0.0 112.102 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 16.6 t-80 -156.79 146.45 20.73 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 120.216 1.371 . . . . 0.0 112.759 -175.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -101.12 135.62 42.3 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.601 1.16 . . . . 0.0 111.391 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 99.6 t -110.16 -53.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.016 0.926 . . . . 0.0 112.018 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.53 -174.23 45.35 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 119.006 0.821 . . . . 0.0 114.459 -174.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 t -123.54 127.62 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 109.511 -176.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.82 4.51 7.34 Favored Glycine 0 CA--C 1.542 1.777 0 N-CA-C 116.376 1.311 . . . . 0.0 116.376 -176.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.3 t -167.87 160.82 12.65 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.269 2.228 . . . . 0.0 111.111 -175.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 86.9 m . . . . . 0 CA--C 1.543 0.7 0 C-N-CA 126.222 1.809 . . . . 0.0 110.998 172.971 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 122.539 1.161 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.429 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -56.24 -37.95 70.45 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.613 1.965 . . . . 0.0 111.875 166.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.1 90.29 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.941 1.297 . . . . 0.0 111.797 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.6 p -83.1 -30.84 27.64 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.316 1.446 . . . . 0.0 113.411 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -53.27 -38.68 63.29 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.68 1.592 . . . . 0.0 113.111 176.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -59.29 -62.73 1.67 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.744 0.818 . . . . 0.0 110.702 171.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -58.62 -23.94 59.98 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -64.35 -48.06 76.95 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.376 1.87 . . . . 0.0 113.257 177.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -155.15 25.19 0.42 Allowed 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.688 1.736 . . . . 0.0 115.688 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.3 mt -128.8 147.78 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.111 -1.618 . . . . 0.0 109.612 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.3 t -146.99 159.38 43.63 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -96.46 4.1 52.35 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 126.626 1.97 . . . . 0.0 112.494 168.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.0 t -161.98 115.76 1.85 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.305 1.842 . . . . 0.0 110.898 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttp-105 -67.36 106.2 2.01 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.574 -1.329 . . . . 0.0 110.724 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -115.51 3.56 14.07 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.293 1.437 . . . . 0.0 113.567 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 p -72.18 143.51 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.708 1.203 . . . . 0.0 112.368 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -130.38 6.54 4.87 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.06 1.744 . . . . 0.0 112.782 170.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.6 m 51.5 38.62 22.63 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.843 2.457 . . . . 0.0 113.962 -177.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -154.67 -27.76 0.12 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.112 2.565 . . . . 0.0 112.895 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -107.61 1.69 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.771 1.629 . . . . 0.0 113.527 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.2 pt -59.86 -13.46 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.43 1.492 . . . . 0.0 113.662 176.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -53.77 -26.05 21.82 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.065 1.346 . . . . 0.0 114.259 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -91.3 -13.23 32.99 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.082 1.353 . . . . 0.0 113.645 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.6 p -93.45 -176.0 3.97 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.792 1.637 . . . . 0.0 112.051 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -64.19 -18.39 64.45 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 169.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -93.16 11.36 28.07 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.011 1.724 . . . . 0.0 114.261 -167.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -64.98 -6.33 8.3 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 128.764 2.825 . . . . 0.0 115.01 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -62.35 -2.39 1.01 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.845 2.058 . . . . 0.0 114.805 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t 53.84 34.04 18.41 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.456 1.902 . . . . 0.0 113.874 -175.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 155.63 12.24 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.881 1.672 . . . . 0.0 112.242 174.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -71.13 -26.67 63.11 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.4 pttt -164.82 165.83 20.22 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 112.236 167.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -137.41 163.65 30.55 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.199 1.0 . . . . 0.0 111.554 166.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.0 m -127.76 92.1 3.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.275 1.43 . . . . 0.0 110.0 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.56 122.86 25.21 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.774 0.83 . . . . 0.0 110.848 175.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.9 mt -99.59 116.23 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.035 1.334 . . . . 0.0 107.812 174.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -89.37 87.35 7.07 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.313 0.578 . . . . 0.0 110.539 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 93.8 p -148.94 166.39 28.75 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.136 1.375 . . . . 0.0 112.602 171.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 30.1 mtt85 -74.17 161.72 77.08 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 124.715 1.206 . . . . 0.0 111.528 170.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.51 -22.32 38.8 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.305 2.003 . . . . 0.0 114.457 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -58.01 17.04 Favored Pre-proline 0 N--CA 1.473 0.72 0 CA-C-N 119.605 1.093 . . . . 0.0 112.714 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.77 -0.57 5.49 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 123.138 2.559 . . . . 0.0 114.94 178.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.4 t -101.14 -55.56 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 126.426 1.89 . . . . 0.0 109.7 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -45.53 81.26 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.087 -1.008 . . . . 0.0 112.971 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.59 -2.9 31.35 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -172.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.3 mt -53.44 -35.63 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.664 0.786 . . . . 0.0 110.468 169.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.5 p -110.38 159.23 17.65 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.63 1.172 . . . . 0.0 113.235 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -156.44 103.11 2.12 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.162 1.785 . . . . 0.0 110.005 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.5 3.55 81.17 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.596 1.093 . . . . 0.0 114.961 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.4 mt -75.31 116.48 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 118.63 1.215 . . . . 0.0 111.241 -178.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.4 mt -110.37 -13.44 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.516 1.926 . . . . 0.0 111.079 173.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.74 2.62 5.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 127.38 2.272 . . . . 0.0 116.298 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t 52.27 67.58 0.95 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.79 1.636 . . . . 0.0 112.507 -170.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -155.14 156.47 35.81 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.646 1.978 . . . . 0.0 110.878 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.532 HD22 HG23 ' A' ' 16' ' ' VAL . 6.1 t-20 -140.72 -171.93 3.34 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.752 -1.218 . . . . 0.0 111.702 162.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.0 t -123.78 139.85 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.647 1.579 . . . . 0.0 108.452 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 34.0 tp -48.44 140.31 8.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.624 1.17 . . . . 0.0 111.893 170.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.45 174.06 0.81 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 174.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.5 t -122.48 -21.59 5.71 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.803 1.241 . . . . 0.0 114.201 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.8 m -86.25 171.47 11.23 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.25 1.42 . . . . 0.0 111.765 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -119.01 109.85 16.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.107 0.963 . . . . 0.0 111.26 -176.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -105.09 159.93 15.45 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 110.295 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.74 108.83 3.56 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.153 0.502 . . . . 0.0 110.35 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.91 121.28 41.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.347 1.459 . . . . 0.0 111.202 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.6 t -125.25 90.44 3.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.106 1.363 . . . . 0.0 110.717 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -80.97 161.09 24.44 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.547 0.739 . . . . 0.0 110.864 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -150.44 134.71 17.09 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 120.937 -1.102 . . . . 0.0 108.185 156.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.99 141.03 52.14 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.051 1.34 . . . . 0.0 109.228 -174.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.5 t -63.36 148.96 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-O 121.701 0.763 . . . . 0.0 112.114 -177.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.3 t -139.68 85.94 2.07 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.955 1.302 . . . . 0.0 111.874 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.252 1.198 0 C-N-CA 126.533 1.933 . . . . 0.0 113.709 178.633 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo . . . . . 0 CA--C 1.537 0.672 0 CA-C-O 120.519 0.133 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -138.98 176.14 8.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.308 1.843 . . . . 0.0 110.353 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -95.27 127.34 41.24 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.568 1.147 . . . . 0.0 110.2 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -135.39 159.25 42.16 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.563 1.145 . . . . 0.0 111.957 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.33 151.68 25.67 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.907 1.683 . . . . 0.0 112.722 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.63 110.22 12.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.204 1.802 . . . . 0.0 111.742 -172.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -134.11 117.7 16.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.587 1.555 . . . . 0.0 111.372 177.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -132.35 151.6 51.79 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.806 1.643 . . . . 0.0 111.406 173.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -152.75 177.04 11.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.114 1.366 . . . . 0.0 112.012 176.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -144.41 103.98 4.03 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.044 0.938 . . . . 0.0 111.058 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.3 p30 -169.58 172.6 6.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.375 1.47 . . . . 0.0 113.224 -173.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.12 171.86 1.19 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 127.585 2.354 . . . . 0.0 114.355 168.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -142.65 146.27 34.3 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.559 1.944 . . . . 0.0 111.597 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.0 t -106.5 142.46 36.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.088 0.955 . . . . 0.0 111.63 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -147.14 -179.53 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.471 1.908 . . . . 0.0 111.697 -174.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.42 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.7 m -126.42 119.81 28.18 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.225 -0.922 . . . . 0.0 111.818 174.662 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.4 t -85.17 128.83 34.82 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.34 1.056 . . . . 0.0 111.341 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -136.5 113.31 10.3 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.023 1.329 . . . . 0.0 108.988 176.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.3 m120 58.27 57.83 3.76 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.985 1.314 . . . . 0.0 112.453 -172.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.98 26.25 14.08 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.398 2.279 . . . . 0.0 114.763 170.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.53 134.16 5.96 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 124.94 1.296 . . . . 0.0 109.516 -177.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -75.32 105.46 2.09 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.698 2.932 . . . . 0.0 112.228 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.437 HG12 ' H ' ' A' ' 51' ' ' TRP . 9.9 m -99.41 11.8 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.26 1.424 . . . . 0.0 111.968 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.42 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 21.5 t-80 -155.75 142.25 18.63 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.114 1.325 . . . . 0.0 112.595 -170.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -98.02 137.6 36.59 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.391 1.076 . . . . 0.0 111.351 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.6 t -111.3 -55.49 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.133 0.973 . . . . 0.0 112.028 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.57 -173.65 43.24 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 118.983 0.811 . . . . 0.0 115.123 -171.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.9 t -127.54 124.03 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.874 1.67 . . . . 0.0 110.051 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.04 3.96 10.08 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.0 p -168.96 163.98 11.47 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.647 2.379 . . . . 0.0 110.924 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m . . . . . 0 CA--C 1.54 0.58 0 C-N-CA 125.112 1.365 . . . . 0.0 110.611 172.015 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 . . . . . 0 CA--C 1.544 0.725 0 CA-C-O 122.059 0.933 . . . . 0.0 109.687 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.437 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.4 t-105 -55.45 -37.94 68.4 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.705 2.002 . . . . 0.0 112.063 167.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -42.34 83.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.827 1.251 . . . . 0.0 111.329 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -87.82 -27.57 22.19 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.568 1.547 . . . . 0.0 114.084 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -50.48 -42.86 55.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.934 1.694 . . . . 0.0 112.782 173.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.67 -62.45 1.72 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.454 1.102 . . . . 0.0 110.797 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -60.31 -23.03 63.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -178.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -64.57 -52.58 56.89 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.34 1.456 . . . . 0.0 113.163 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -149.95 22.64 0.87 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -175.363 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -125.69 150.08 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 120.362 -1.461 . . . . 0.0 109.246 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.6 t -145.39 152.58 40.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -84.31 -1.81 55.97 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.156 1.782 . . . . 0.0 112.963 168.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -163.65 114.71 1.37 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.391 1.876 . . . . 0.0 111.178 176.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -66.59 105.87 1.64 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.348 -1.47 . . . . 0.0 110.683 173.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -115.18 1.29 13.81 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.275 1.43 . . . . 0.0 113.595 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.435 HG22 ' H ' ' A' ' 67' ' ' CYS . 7.7 p -72.3 143.04 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.818 1.247 . . . . 0.0 112.229 178.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -130.77 12.66 5.31 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.123 1.769 . . . . 0.0 112.226 170.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.435 ' H ' HG22 ' A' ' 65' ' ' VAL . 6.4 m 51.67 38.41 22.67 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.905 2.482 . . . . 0.0 112.704 -173.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -147.86 -43.01 0.16 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.808 2.443 . . . . 0.0 112.519 -168.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.4 p30 -93.0 -6.26 48.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.141 1.377 . . . . 0.0 113.347 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.9 pt -63.34 -10.78 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.509 1.124 . . . . 0.0 113.492 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -56.38 -19.78 16.38 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.887 1.275 . . . . 0.0 114.128 164.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.3 t -114.76 -2.33 13.02 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.425 1.89 . . . . 0.0 113.78 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.5 p -98.52 -174.37 2.79 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.122 1.369 . . . . 0.0 110.886 172.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -64.02 -18.08 63.97 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.801 -1.187 . . . . 0.0 113.622 173.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -94.53 14.03 22.12 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.867 1.667 . . . . 0.0 114.275 -165.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -66.32 -4.16 7.39 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 128.514 2.726 . . . . 0.0 114.922 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -62.96 -2.9 1.36 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.651 1.98 . . . . 0.0 115.16 -174.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.8 t 57.17 32.26 21.41 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.938 1.695 . . . . 0.0 113.596 -176.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.21 155.27 25.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.103 1.361 . . . . 0.0 112.334 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -64.62 -30.99 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -170.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.25 164.17 22.54 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.015 1.726 . . . . 0.0 111.407 166.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -128.78 159.26 36.25 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.184 0.593 . . . . 0.0 110.159 161.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.1 m -122.05 93.51 4.01 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.828 1.251 . . . . 0.0 109.578 173.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -78.25 128.0 33.08 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.563 0.745 . . . . 0.0 111.114 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.1 mt -103.4 111.77 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.385 1.474 . . . . 0.0 107.447 173.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -80.62 88.83 5.69 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.728 -0.608 . . . . 0.0 109.69 168.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 71.1 m -149.21 159.31 44.36 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.069 1.348 . . . . 0.0 112.849 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -73.39 162.75 72.88 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 124.641 1.176 . . . . 0.0 110.35 166.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.8 -23.13 30.97 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.135 1.89 . . . . 0.0 114.428 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.97 -56.84 27.99 Favored Pre-proline 0 N--CA 1.474 0.744 0 CA-C-O 117.974 -1.013 . . . . 0.0 113.183 -176.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.69 -1.12 7.87 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.982 2.455 . . . . 0.0 114.863 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.2 t -100.81 -54.32 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.282 1.833 . . . . 0.0 109.668 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -44.79 79.41 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.225 -0.922 . . . . 0.0 112.969 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.25 -4.2 37.62 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -172.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.7 mt -53.08 -35.22 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.876 0.87 . . . . 0.0 110.799 170.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.6 p -112.53 158.07 20.38 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.271 1.429 . . . . 0.0 113.315 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -154.83 107.79 2.81 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.56 1.944 . . . . 0.0 109.803 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.56 3.24 88.51 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.411 1.005 . . . . 0.0 114.957 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 51.1 mt -76.43 117.62 21.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.887 1.275 . . . . 0.0 111.037 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.98 -12.04 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 126.729 2.012 . . . . 0.0 110.964 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 3.7 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.325 2.25 . . . . 0.0 116.12 -170.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.26 67.93 0.9 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.736 1.614 . . . . 0.0 113.062 -171.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -158.53 153.56 25.25 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.164 1.786 . . . . 0.0 110.717 177.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -138.46 -170.91 2.93 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.822 -1.174 . . . . 0.0 111.128 165.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.0 t -125.59 139.85 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.431 1.492 . . . . 0.0 108.578 173.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.0 tp -48.77 139.72 9.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.502 1.121 . . . . 0.0 111.947 170.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.25 172.33 1.51 Allowed 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 174.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -120.09 -24.47 6.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.701 1.201 . . . . 0.0 113.996 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -82.07 172.68 12.94 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.233 1.413 . . . . 0.0 112.089 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -119.16 105.36 11.3 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.595 1.158 . . . . 0.0 111.382 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -100.61 162.29 13.03 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.0 1.72 . . . . 0.0 110.854 -174.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -73.49 105.37 4.81 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.759 -0.588 . . . . 0.0 110.506 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.83 123.09 39.25 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.741 1.216 . . . . 0.0 111.471 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 42.4 t -127.05 91.2 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.006 1.322 . . . . 0.0 110.892 -174.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -83.95 164.39 19.41 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.682 0.753 . . . . 0.0 111.591 169.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -154.2 119.87 5.21 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.192 -0.943 . . . . 0.0 109.025 161.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -107.66 139.46 42.17 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.325 1.05 . . . . 0.0 110.239 -174.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.14 149.55 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.174 0.589 . . . . 0.0 112.198 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.1 t -142.14 95.06 2.74 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 122.099 0.952 . . . . 0.0 112.667 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.864 2.066 . . . . 0.0 113.952 179.127 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 CA--C 1.541 0.857 0 CA-C-O 120.47 0.112 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -144.84 -178.11 5.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.774 2.029 . . . . 0.0 110.742 -174.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -105.45 127.08 52.8 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.352 1.461 . . . . 0.0 110.418 177.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -134.34 164.29 27.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.888 1.275 . . . . 0.0 112.23 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -116.04 153.29 31.95 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.793 2.037 . . . . 0.0 112.646 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.33 113.99 22.07 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.475 1.91 . . . . 0.0 111.577 -168.014 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -137.87 103.06 4.88 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.641 1.576 . . . . 0.0 112.424 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -117.35 140.98 48.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.079 1.351 . . . . 0.0 111.279 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -147.2 165.68 29.3 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.648 1.579 . . . . 0.0 111.484 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -140.21 103.67 4.64 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.614 -0.679 . . . . 0.0 111.209 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -171.48 170.7 5.72 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.803 1.241 . . . . 0.0 113.248 -169.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 171.62 1.45 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.571 2.349 . . . . 0.0 113.89 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.5 p90 -141.83 147.0 36.51 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.336 1.854 . . . . 0.0 111.453 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.6 t -105.45 144.31 32.39 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.839 0.856 . . . . 0.0 111.063 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.8 m -148.36 -178.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.336 1.855 . . . . 0.0 111.804 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -128.09 117.66 22.03 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.022 1.329 . . . . 0.0 111.877 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 18.7 t -85.32 129.43 34.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.467 1.107 . . . . 0.0 111.729 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -135.61 114.1 11.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 125.021 1.329 . . . . 0.0 109.113 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.5 m120 57.46 57.25 4.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.876 1.27 . . . . 0.0 112.445 -172.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.4 26.18 13.5 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.458 2.303 . . . . 0.0 114.745 170.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.01 134.29 5.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.111 1.365 . . . . 0.0 109.709 -177.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.55 110.08 3.03 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 123.551 2.834 . . . . 0.0 113.351 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.457 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.4 m -108.01 17.03 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 126.42 1.888 . . . . 0.0 112.347 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -153.8 141.3 19.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.66 -1.275 . . . . 0.0 111.113 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -84.69 154.23 22.6 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.124 0.57 . . . . 0.0 110.274 169.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.1 t -130.1 -44.6 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.04 -174.96 47.23 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 119.74 1.155 . . . . 0.0 115.262 -174.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -130.79 116.67 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.03 1.732 . . . . 0.0 110.024 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.34 3.29 31.06 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 115.17 0.828 . . . . 0.0 115.17 -174.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 98.4 p -167.9 167.6 12.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 128.156 2.582 . . . . 0.0 110.387 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 78.4 m . . . . . 0 CA--C 1.539 0.555 0 C-N-CA 125.256 1.422 . . . . 0.0 110.34 171.179 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 . . . . . 0 CA--C 1.542 0.65 0 CA-C-O 122.038 0.923 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.457 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -56.48 -37.41 70.32 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 126.076 1.751 . . . . 0.0 111.734 168.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.63 -37.62 76.31 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.486 1.114 . . . . 0.0 111.731 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -90.94 -27.1 18.93 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.599 1.16 . . . . 0.0 113.926 175.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -51.07 -43.01 60.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 126.136 1.774 . . . . 0.0 113.036 174.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -56.4 -62.21 1.88 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.507 1.123 . . . . 0.0 110.961 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.59 -27.49 62.76 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.8 tptt -65.11 -51.02 63.74 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.019 1.328 . . . . 0.0 113.726 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -148.84 22.82 0.99 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -128.3 147.94 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.11 1.364 . . . . 0.0 109.434 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.4 t -147.88 154.36 40.3 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -85.65 1.51 48.97 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.21 1.804 . . . . 0.0 113.112 167.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.6 t -162.38 104.19 1.1 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.685 1.994 . . . . 0.0 110.953 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -67.33 109.06 2.98 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.546 -1.346 . . . . 0.0 110.121 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.81 5.69 17.64 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.305 1.442 . . . . 0.0 113.005 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -77.2 139.3 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.871 1.268 . . . . 0.0 111.898 -174.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -127.36 7.86 6.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.096 1.758 . . . . 0.0 112.819 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 m 53.03 37.26 24.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.424 2.29 . . . . 0.0 113.816 -178.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -151.03 -33.36 0.16 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.831 2.452 . . . . 0.0 111.853 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -97.52 -5.25 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.852 1.661 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.7 pt -62.32 -12.21 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.947 1.299 . . . . 0.0 113.633 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -55.68 -33.39 64.09 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.738 0.815 . . . . 0.0 112.387 168.564 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -77.54 -12.57 59.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.263 1.425 . . . . 0.0 114.207 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -100.49 -175.36 2.89 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.539 1.536 . . . . 0.0 112.422 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -63.34 -19.95 65.08 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -94.25 12.79 25.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.783 1.633 . . . . 0.0 114.199 -165.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -64.68 -5.79 6.47 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 128.999 2.919 . . . . 0.0 115.136 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -62.32 -2.06 0.91 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.739 2.016 . . . . 0.0 114.919 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.8 t 55.98 31.46 18.0 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.101 1.76 . . . . 0.0 113.981 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 156.81 24.37 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.847 1.659 . . . . 0.0 112.527 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -63.23 -34.13 76.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.654 1.182 . . . . 0.0 114.155 -171.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.4 ptmm? -162.64 160.57 25.87 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.913 1.685 . . . . 0.0 112.473 168.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -129.85 159.01 37.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.029 0.932 . . . . 0.0 110.152 161.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.9 m -123.7 92.73 3.74 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.164 1.386 . . . . 0.0 109.503 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -79.48 121.85 25.71 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.166 0.986 . . . . 0.0 111.168 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.9 mt -97.25 117.25 41.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.242 1.417 . . . . 0.0 107.897 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -89.05 90.81 8.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.249 0.547 . . . . 0.0 110.294 167.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.0 p -144.67 172.04 13.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.337 1.455 . . . . 0.0 112.311 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -79.3 164.27 55.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 124.434 1.094 . . . . 0.0 109.779 164.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 -22.88 22.03 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.179 1.92 . . . . 0.0 114.284 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.24 -54.97 49.92 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-O 118.018 -0.991 . . . . 0.0 113.293 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.95 -1.28 8.36 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.236 2.624 . . . . 0.0 114.785 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 15.7 t -99.7 -53.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 126.141 1.776 . . . . 0.0 109.708 175.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -45.37 78.83 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.36 -0.837 . . . . 0.0 112.869 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.36 -3.54 37.42 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.3 mt -53.83 -36.19 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 123.514 0.726 . . . . 0.0 110.491 170.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.2 p -108.92 158.04 18.07 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.798 1.239 . . . . 0.0 113.031 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -156.2 104.84 2.27 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.657 1.583 . . . . 0.0 110.785 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 1.84 81.36 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.656 1.122 . . . . 0.0 115.002 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.66 119.91 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.899 1.279 . . . . 0.0 111.237 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.3 mt -112.27 -13.19 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.591 1.956 . . . . 0.0 110.927 173.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.93 4.14 5.77 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.441 2.296 . . . . 0.0 116.341 -168.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 53.2 68.16 0.88 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.646 1.579 . . . . 0.0 112.998 -171.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -159.83 152.86 21.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.161 1.784 . . . . 0.0 110.907 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -141.65 -170.24 3.07 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.817 -1.177 . . . . 0.0 111.524 166.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.92 142.62 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.747 1.619 . . . . 0.0 108.656 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.1 tp -51.12 140.66 15.7 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.229 1.011 . . . . 0.0 111.721 168.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.77 172.93 1.46 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -118.42 -31.47 4.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.872 1.269 . . . . 0.0 113.354 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.5 m -74.3 170.54 15.39 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.701 1.601 . . . . 0.0 112.334 175.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -120.34 102.31 8.39 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.326 1.051 . . . . 0.0 111.601 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -95.27 161.57 14.04 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.081 1.752 . . . . 0.0 110.978 -175.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -74.63 101.35 4.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.726 0.81 . . . . 0.0 110.53 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -96.1 128.8 43.33 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.943 1.297 . . . . 0.0 112.3 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.9 t -129.6 96.09 4.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.783 1.633 . . . . 0.0 110.672 -173.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -94.17 157.34 16.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.845 0.831 . . . . 0.0 111.585 172.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -147.43 117.86 7.43 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.271 1.028 . . . . 0.0 109.474 167.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -106.36 138.12 43.11 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.632 1.173 . . . . 0.0 110.099 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.9 t -61.15 146.92 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.673 0.789 . . . . 0.0 111.624 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 5.7 t -137.91 88.56 2.33 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.894 1.33 . . . . 0.0 111.39 174.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.343 1.857 . . . . 0.0 112.935 175.046 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo . . . . . 0 CA--C 1.545 1.071 0 N-CA-C 114.453 0.905 . . . . 0.0 114.453 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.2 m -127.62 160.4 31.74 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.171 1.788 . . . . 0.0 109.782 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.0 140.55 29.38 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.509 1.124 . . . . 0.0 110.136 173.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -138.93 159.75 41.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.057 1.343 . . . . 0.0 112.32 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -92.67 156.22 17.21 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.144 2.178 . . . . 0.0 111.948 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -89.7 113.4 24.89 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.271 1.828 . . . . 0.0 111.128 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -137.16 93.06 2.78 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.884 1.274 . . . . 0.0 111.929 174.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -109.07 136.18 49.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.017 1.327 . . . . 0.0 110.758 177.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 m -143.46 171.46 14.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.591 1.556 . . . . 0.0 111.737 -174.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -143.54 104.68 4.25 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.137 -0.977 . . . . 0.0 111.439 175.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.6 p30 -171.52 172.72 4.97 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.112 1.365 . . . . 0.0 113.332 -169.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.37 173.42 1.57 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.551 2.34 . . . . 0.0 114.233 168.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -142.88 147.53 35.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.759 2.024 . . . . 0.0 111.51 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -107.25 142.55 36.83 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.028 0.931 . . . . 0.0 111.501 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.534 HG23 HD22 ' A' ' 104' ' ' ASN . 16.1 m -147.98 -178.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 126.305 1.842 . . . . 0.0 111.65 -174.158 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.4 m -127.06 119.69 27.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.115 0.966 . . . . 0.0 111.195 174.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.73 132.73 34.03 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.708 0.803 . . . . 0.0 111.365 174.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -137.08 118.23 14.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.365 1.466 . . . . 0.0 108.488 174.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.8 m120 56.37 55.44 6.61 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.65 1.18 . . . . 0.0 112.495 -171.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.54 25.16 11.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.675 2.39 . . . . 0.0 115.038 169.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.11 133.33 6.1 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 124.779 1.232 . . . . 0.0 109.439 -175.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.0 104.57 1.93 Allowed 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.848 3.032 . . . . 0.0 112.163 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.439 HG12 ' H ' ' A' ' 51' ' ' TRP . 7.7 m -102.05 14.59 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.394 1.478 . . . . 0.0 112.194 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.417 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 18.3 t-80 -156.59 142.59 18.0 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 120.111 1.323 . . . . 0.0 112.259 -173.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -97.58 141.19 30.92 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.258 1.023 . . . . 0.0 111.216 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 78.0 t -115.71 -53.86 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.057 0.943 . . . . 0.0 112.208 177.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.8 -172.78 42.64 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 119.122 0.874 . . . . 0.0 115.089 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -128.5 122.25 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 126.006 1.722 . . . . 0.0 110.034 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.82 1.46 12.03 Favored Glycine 0 CA--C 1.541 1.672 0 N-CA-C 115.856 1.102 . . . . 0.0 115.856 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.6 t -169.08 164.63 11.29 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.879 2.472 . . . . 0.0 110.316 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.6 m . . . . . 0 CA--C 1.541 0.62 0 C-N-CA 125.841 1.657 . . . . 0.0 111.174 173.798 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 CA--C 1.539 0.522 0 CA-C-O 122.805 1.288 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.439 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.8 t-105 -54.74 -36.69 65.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.427 1.891 . . . . 0.0 112.41 170.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -26.97 68.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.753 1.221 . . . . 0.0 113.06 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.7 p -89.43 -31.6 17.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.658 1.183 . . . . 0.0 113.649 167.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.01 -39.69 72.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.89 1.676 . . . . 0.0 113.11 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -57.42 -65.43 0.63 Allowed 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.435 1.094 . . . . 0.0 110.526 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -60.67 -22.33 63.78 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -61.73 -55.09 33.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.465 1.506 . . . . 0.0 113.329 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -147.88 21.96 1.12 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -172.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.0 mt -129.22 146.84 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.095 1.358 . . . . 0.0 109.695 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.9 t -147.35 153.82 40.15 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 174.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -84.73 0.86 49.05 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.088 1.755 . . . . 0.0 113.112 168.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.2 t -161.26 105.76 1.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.529 1.932 . . . . 0.0 110.932 175.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -66.99 108.34 2.56 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.545 -1.347 . . . . 0.0 110.13 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -114.44 4.38 15.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.328 1.451 . . . . 0.0 113.026 176.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.4 t -83.4 138.04 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.133 0.973 . . . . 0.0 111.437 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -124.55 8.61 8.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.127 1.771 . . . . 0.0 112.398 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.3 m 52.03 44.64 29.37 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.385 2.274 . . . . 0.0 113.26 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -160.55 -20.07 0.06 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.201 2.2 . . . . 0.0 113.718 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -106.39 -1.98 22.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.826 1.25 . . . . 0.0 113.671 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.45 -13.72 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.434 1.493 . . . . 0.0 114.195 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 4.6 ptm -51.07 -25.11 4.53 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.23 1.412 . . . . 0.0 114.587 164.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 t -95.66 -15.58 22.62 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.663 1.585 . . . . 0.0 113.584 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 p -90.39 -174.73 4.25 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.698 1.599 . . . . 0.0 112.188 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -63.38 -20.73 65.79 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.146 -0.971 . . . . 0.0 113.572 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.27 20.01 8.7 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.606 1.963 . . . . 0.0 113.424 -170.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -65.59 -10.12 32.72 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.601 2.36 . . . . 0.0 114.537 -174.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -61.8 -3.13 1.01 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.89 2.476 . . . . 0.0 115.369 -175.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.93 25.47 6.83 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.296 1.838 . . . . 0.0 114.185 -177.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 161.3 4.27 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 113.692 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -63.98 -34.81 78.84 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.472 1.509 . . . . 0.0 114.346 -168.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -165.35 158.53 16.25 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.446 1.498 . . . . 0.0 112.421 175.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -140.43 128.23 21.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.797 1.239 . . . . 0.0 110.015 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 54.2 m -91.87 94.34 9.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.679 1.192 . . . . 0.0 110.551 171.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -79.81 125.91 30.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.243 0.617 . . . . 0.0 111.175 175.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.0 mt -99.8 114.48 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.367 1.467 . . . . 0.0 108.057 172.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -84.91 87.36 7.34 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.735 -0.603 . . . . 0.0 110.109 167.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 t -152.17 171.23 18.25 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.201 1.0 . . . . 0.0 113.138 170.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -77.07 163.85 62.6 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.975 2.11 . . . . 0.0 110.852 173.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.58 -23.2 23.48 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.347 2.031 . . . . 0.0 114.408 176.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -60.15 -57.93 23.06 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 124.605 1.162 . . . . 0.0 113.211 -177.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -70.0 -0.81 7.66 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.164 2.576 . . . . 0.0 114.813 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -100.26 -55.19 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.327 1.851 . . . . 0.0 109.549 176.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -44.2 82.39 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.224 -0.922 . . . . 0.0 112.97 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.21 -4.38 38.56 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 61.7 mt -53.17 -36.01 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.713 0.805 . . . . 0.0 110.672 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 32.0 p -110.22 159.1 17.69 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.528 1.131 . . . . 0.0 113.056 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -156.35 103.77 2.18 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.623 1.569 . . . . 0.0 110.688 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.65 3.7 85.97 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.288 0.947 . . . . 0.0 114.912 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.3 mt -74.32 115.22 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.544 1.172 . . . . 0.0 111.161 -178.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.9 mt -108.43 -14.11 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.442 1.897 . . . . 0.0 110.867 171.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.42 5.76 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.732 2.413 . . . . 0.0 116.396 -169.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.2 t 51.42 65.87 1.36 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.498 1.519 . . . . 0.0 112.862 -171.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -154.89 157.06 37.23 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.206 1.803 . . . . 0.0 111.106 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.534 HD22 HG23 ' A' ' 16' ' ' VAL . 6.2 t-20 -142.29 -170.15 3.11 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.859 -1.151 . . . . 0.0 111.778 163.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.15 142.4 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.833 1.653 . . . . 0.0 108.625 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp -49.67 140.86 10.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.587 1.155 . . . . 0.0 111.945 169.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.49 172.66 1.48 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -118.06 -30.54 5.3 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.89 1.276 . . . . 0.0 113.474 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.2 m -76.91 171.5 14.66 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.801 1.64 . . . . 0.0 112.457 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -118.84 102.34 8.73 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.434 1.094 . . . . 0.0 111.667 -176.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -95.53 161.62 13.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.007 1.723 . . . . 0.0 111.135 -176.045 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -75.22 100.83 4.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.327 0.651 . . . . 0.0 110.537 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.24 128.99 37.28 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.203 . . . . 0.0 112.049 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 44.4 t -130.59 90.08 2.87 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 125.654 1.581 . . . . 0.0 110.074 -175.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -88.6 160.2 17.53 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.865 0.84 . . . . 0.0 111.419 171.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.3 m -147.35 142.79 27.47 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 125.586 1.554 . . . . 0.0 107.951 164.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -132.76 128.91 37.85 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.616 1.167 . . . . 0.0 109.755 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.6 t -57.77 147.22 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.962 0.905 . . . . 0.0 111.703 -176.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.65 103.61 5.28 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.158 0.983 . . . . 0.0 112.31 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.563 1.945 . . . . 0.0 113.473 179.748 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo . . . . . 0 CA--C 1.539 0.736 0 N-CA-C 112.538 0.168 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.89 175.81 10.15 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.022 2.129 . . . . 0.0 110.119 -177.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -106.82 128.65 54.44 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.877 1.271 . . . . 0.0 110.672 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -135.22 158.19 45.01 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.78 1.232 . . . . 0.0 112.669 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.0 mtpp -89.02 155.9 19.2 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.618 2.367 . . . . 0.0 111.407 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.29 105.13 17.25 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.573 1.549 . . . . 0.0 110.513 -176.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -132.3 101.9 5.55 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.131 1.373 . . . . 0.0 112.278 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -114.08 137.51 51.63 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.608 1.563 . . . . 0.0 110.971 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.2 m -142.33 169.13 18.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.868 1.667 . . . . 0.0 111.047 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -143.54 103.79 4.14 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.077 -1.015 . . . . 0.0 111.387 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -169.83 172.16 6.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.799 1.24 . . . . 0.0 113.535 -170.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.81 170.28 0.43 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 128.974 2.909 . . . . 0.0 114.327 165.551 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.58 150.47 36.45 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.884 2.074 . . . . 0.0 111.395 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.1 t -112.29 146.25 38.55 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.845 0.831 . . . . 0.0 112.434 176.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.2 m -149.19 -177.31 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.596 1.958 . . . . 0.0 111.697 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.6 m -128.11 116.26 19.68 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 125.029 1.332 . . . . 0.0 111.908 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.5 t -83.91 130.24 34.91 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.101 0.96 . . . . 0.0 111.433 176.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -137.09 115.04 11.45 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.954 1.302 . . . . 0.0 108.969 174.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.5 m120 57.53 57.31 4.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.869 1.268 . . . . 0.0 112.498 -172.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 64.4 26.1 13.48 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.254 2.222 . . . . 0.0 114.734 170.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.21 134.43 5.77 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.227 1.411 . . . . 0.0 109.528 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.498 2.799 . . . . 0.0 113.317 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.8 m -106.62 16.84 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.498 1.919 . . . . 0.0 112.566 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -153.14 142.97 22.08 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.631 -1.293 . . . . 0.0 111.322 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -84.38 154.52 22.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.986 0.514 . . . . 0.0 110.419 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.3 t -124.28 -55.49 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.571 0.749 . . . . 0.0 112.339 167.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.09 -172.34 43.25 Favored Glycine 0 CA--C 1.53 1.028 0 CA-C-N 119.028 0.831 . . . . 0.0 115.104 -170.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -127.13 123.03 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.823 1.649 . . . . 0.0 110.672 -169.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.24 1.04 8.72 Favored Glycine 0 CA--C 1.541 1.66 0 C-N-CA 124.973 1.273 . . . . 0.0 115.97 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.7 m -166.09 166.6 17.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 129.912 3.285 . . . . 0.0 108.964 -174.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t . . . . . 0 CA--C 1.541 0.606 0 C-N-CA 124.424 1.09 . . . . 0.0 111.181 -179.217 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 CA--C 1.545 0.755 0 CA-C-O 122.3 1.048 . . . . 0.0 110.611 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -56.96 -35.94 69.72 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.748 2.019 . . . . 0.0 112.297 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -32.01 70.1 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.971 1.309 . . . . 0.0 112.448 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.8 p -92.22 -28.72 16.85 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.734 1.613 . . . . 0.0 113.859 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -52.73 -45.48 67.0 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.429 1.492 . . . . 0.0 112.55 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -55.61 -60.68 3.09 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.417 1.087 . . . . 0.0 110.812 175.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 34.1 mttp -58.01 -25.26 60.87 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmtp -68.49 -54.38 17.23 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.058 1.343 . . . . 0.0 113.687 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -141.7 14.91 2.14 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.81 1.782 . . . . 0.0 115.81 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.0 mt -126.33 146.09 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 O-C-N 120.771 -1.205 . . . . 0.0 110.066 175.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -142.56 151.92 42.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.392 0.677 . . . . 0.0 112.352 170.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -87.73 0.32 55.89 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.207 1.403 . . . . 0.0 112.206 170.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 t -159.44 107.17 1.76 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.421 1.888 . . . . 0.0 110.593 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -64.35 105.41 0.92 Allowed 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.734 -1.229 . . . . 0.0 110.973 175.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -112.25 1.77 16.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.347 1.459 . . . . 0.0 113.431 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.6 p -75.22 145.52 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.087 1.355 . . . . 0.0 112.572 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -132.34 8.42 4.3 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.172 1.789 . . . . 0.0 112.782 172.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 52.1 m 51.45 37.38 19.14 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.786 2.434 . . . . 0.0 114.011 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -148.28 -22.05 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.421 2.689 . . . . 0.0 112.896 176.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -106.65 -3.37 20.72 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.564 1.546 . . . . 0.0 113.398 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.2 pt -64.37 -8.94 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 113.571 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.6 ttt -56.67 -23.28 40.66 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.153 1.381 . . . . 0.0 113.123 164.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.8 t -99.86 -3.25 32.93 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.24 1.816 . . . . 0.0 114.076 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.6 p -107.42 -176.79 3.17 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.064 1.345 . . . . 0.0 111.373 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -64.37 -17.11 63.43 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.952 -1.092 . . . . 0.0 113.463 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -92.06 17.96 8.68 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.573 1.949 . . . . 0.0 113.849 -173.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -66.61 -8.01 24.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.707 2.003 . . . . 0.0 114.27 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -60.77 -2.47 0.55 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 128.252 2.621 . . . . 0.0 115.958 -175.035 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.9 t 49.09 53.73 12.11 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.182 1.793 . . . . 0.0 113.058 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 167.38 2.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.598 1.159 . . . . 0.0 112.303 170.608 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -76.49 -29.26 56.78 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.839 1.255 . . . . 0.0 112.764 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? -170.33 161.43 8.13 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.485 2.314 . . . . 0.0 110.642 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -147.08 143.45 28.33 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.599 0.76 . . . . 0.0 110.819 164.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 56.2 m -90.88 115.07 27.64 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.063 1.345 . . . . 0.0 109.197 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.94 128.34 43.8 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.481 1.037 . . . . 0.0 111.042 165.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.5 mt -99.97 112.87 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.662 1.585 . . . . 0.0 107.062 174.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -86.82 92.18 8.89 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.538 -0.726 . . . . 0.0 109.636 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 83.6 p -146.84 177.18 9.32 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.633 1.573 . . . . 0.0 112.728 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.31 160.04 46.27 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.385 1.474 . . . . 0.0 110.503 164.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -72.66 -22.08 21.15 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.584 2.189 . . . . 0.0 114.305 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.37 -55.78 41.85 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 124.902 1.281 . . . . 0.0 112.369 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.56 -0.93 7.45 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.371 2.714 . . . . 0.0 115.187 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.73 -53.89 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.718 1.607 . . . . 0.0 110.003 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -43.93 81.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.258 -0.902 . . . . 0.0 112.747 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.5 -3.49 37.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -172.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 56.6 mt -53.73 -35.78 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.627 0.771 . . . . 0.0 110.332 170.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.5 p -111.26 157.51 20.05 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.856 1.263 . . . . 0.0 113.304 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -154.5 110.62 3.23 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.571 1.948 . . . . 0.0 109.756 175.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.47 88.53 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.645 1.117 . . . . 0.0 114.873 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -77.47 116.82 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.681 1.192 . . . . 0.0 111.067 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.8 mt -111.61 -11.4 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.786 2.034 . . . . 0.0 110.769 173.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.2 5.89 4.03 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.617 2.367 . . . . 0.0 116.118 -170.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.3 t 52.71 64.93 1.67 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.568 1.547 . . . . 0.0 112.975 -173.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -157.33 152.57 26.11 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 126.053 1.741 . . . . 0.0 110.721 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -138.71 -172.03 3.21 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.909 -1.119 . . . . 0.0 111.645 164.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.8 t -124.37 141.22 45.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 125.59 1.556 . . . . 0.0 108.51 173.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.7 tp -49.63 140.93 10.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.505 1.122 . . . . 0.0 111.784 170.061 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.68 174.11 0.86 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 174.056 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 12.5 t -122.39 -20.92 5.95 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.114 1.366 . . . . 0.0 113.762 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.4 m -85.66 171.73 11.42 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.737 1.615 . . . . 0.0 111.902 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.32 109.53 16.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.446 1.099 . . . . 0.0 111.41 -178.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -105.12 160.19 15.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.926 1.69 . . . . 0.0 110.293 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -71.67 108.79 5.19 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.708 -0.62 . . . . 0.0 110.711 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -95.66 121.96 37.92 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.573 1.149 . . . . 0.0 111.574 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.4 t -121.92 88.66 2.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.269 1.828 . . . . 0.0 109.523 -175.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -88.14 158.62 18.49 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.384 -0.823 . . . . 0.0 111.166 173.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.2 m -145.74 141.23 27.81 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.041 0.936 . . . . 0.0 108.538 162.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -133.27 128.3 35.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.211 1.405 . . . . 0.0 110.008 -173.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.8 t -59.5 145.77 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-N 118.87 0.759 . . . . 0.0 112.54 -175.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.6 t -133.02 100.19 4.81 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.777 1.631 . . . . 0.0 111.011 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 C--O 1.253 1.284 0 C-N-CA 126.564 1.945 . . . . 0.0 111.519 -178.252 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 CA--C 1.54 0.793 0 CA-C-O 120.602 0.168 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.8 m -139.67 171.82 13.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.597 2.359 . . . . 0.0 109.813 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -91.51 137.19 32.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.716 1.207 . . . . 0.0 110.451 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -137.44 165.05 27.19 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.401 . . . . 0.0 111.94 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mtpt -98.84 159.02 15.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 127.247 2.219 . . . . 0.0 112.08 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.64 110.43 21.75 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.276 1.83 . . . . 0.0 111.583 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -135.8 115.66 13.09 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.203 1.801 . . . . 0.0 111.322 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -122.16 150.34 42.37 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.376 1.07 . . . . 0.0 111.548 176.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -150.48 170.65 18.59 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.987 1.315 . . . . 0.0 111.788 173.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -140.81 104.33 4.68 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.866 0.866 . . . . 0.0 110.963 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -168.6 172.99 7.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.146 1.378 . . . . 0.0 112.767 -172.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.85 172.21 1.39 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.41 1.884 . . . . 0.0 113.941 168.07 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -139.22 155.63 47.66 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.42 1.888 . . . . 0.0 110.161 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.5 t -113.91 146.24 40.34 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.078 1.351 . . . . 0.0 111.769 174.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.6 m -148.95 -178.45 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 126.415 1.886 . . . . 0.0 111.744 -175.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -125.51 117.73 24.24 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.96 1.304 . . . . 0.0 111.715 175.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.74 130.99 34.95 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.083 0.953 . . . . 0.0 111.503 176.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -138.51 112.66 8.61 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.127 1.371 . . . . 0.0 108.978 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.4 m120 57.92 57.81 3.94 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.914 1.286 . . . . 0.0 112.451 -172.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 63.97 26.95 14.26 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.407 2.283 . . . . 0.0 114.776 170.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -160.08 134.89 5.53 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.231 1.413 . . . . 0.0 109.744 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -75.85 109.1 2.83 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.667 2.911 . . . . 0.0 113.38 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.7 m -109.27 17.56 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.611 1.965 . . . . 0.0 112.722 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -152.68 139.18 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.576 -1.328 . . . . 0.0 110.656 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -84.49 147.88 26.83 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.954 0.502 . . . . 0.0 110.879 170.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.4 t -121.28 -54.49 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.404 0.682 . . . . 0.0 112.573 175.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.87 -173.66 43.51 Favored Glycine 0 CA--C 1.528 0.865 0 CA-C-N 119.247 0.931 . . . . 0.0 115.149 -171.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 t -129.19 118.48 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.892 1.677 . . . . 0.0 110.181 -172.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.43 4.76 25.76 Favored Glycine 0 CA--C 1.542 1.75 0 N-CA-C 115.663 1.025 . . . . 0.0 115.663 -174.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.2 p -165.82 166.0 17.98 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.625 2.37 . . . . 0.0 111.123 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.0 m . . . . . 0 CA--C 1.539 0.553 0 C-N-CA 125.341 1.457 . . . . 0.0 110.526 172.486 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 p30 . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 122.606 1.194 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -59.74 -35.17 74.02 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 0.0 112.943 173.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -48.11 83.04 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.501 1.12 . . . . 0.0 110.977 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.8 p -74.53 -31.18 62.05 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.42 1.488 . . . . 0.0 113.481 174.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -54.79 -41.14 70.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.055 1.342 . . . . 0.0 113.068 175.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -60.43 -61.71 2.4 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.514 0.725 . . . . 0.0 110.484 173.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.12 -21.35 59.15 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -65.13 -56.53 12.41 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.235 1.814 . . . . 0.0 113.017 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -147.45 22.81 1.16 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.529 1.678 . . . . 0.0 115.529 -172.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -126.6 147.73 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.368 1.467 . . . . 0.0 109.291 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -143.36 152.75 41.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -84.24 -1.52 55.35 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.869 1.668 . . . . 0.0 112.804 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.2 t -162.32 109.73 1.33 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.337 1.855 . . . . 0.0 110.971 176.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.4 ttp85 -67.17 106.5 2.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 120.459 -1.401 . . . . 0.0 110.556 172.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.35 3.05 13.3 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.129 1.372 . . . . 0.0 113.036 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.411 HG22 ' H ' ' A' ' 67' ' ' CYS . 13.8 p -74.64 147.26 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.775 1.23 . . . . 0.0 113.168 -174.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -132.03 2.13 3.95 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.2 1.8 . . . . 0.0 113.266 174.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.411 ' H ' HG22 ' A' ' 65' ' ' VAL . 93.8 m 45.66 54.31 7.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.447 2.299 . . . . 0.0 113.346 -174.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -152.89 -29.88 0.14 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.372 2.669 . . . . 0.0 111.751 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -108.94 -4.06 17.04 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.77 1.628 . . . . 0.0 114.136 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.9 pt -61.98 -7.74 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.9 tpt -52.46 -27.8 17.59 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.277 1.431 . . . . 0.0 113.823 169.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 99.9 p -90.45 -5.14 56.44 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 p -100.43 -179.39 4.09 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.715 1.606 . . . . 0.0 111.695 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -68.92 -15.51 63.51 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.93 5.77 18.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.319 1.848 . . . . 0.0 114.849 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -63.14 -8.19 7.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.939 2.496 . . . . 0.0 115.207 -174.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -62.07 -5.68 2.4 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.446 1.898 . . . . 0.0 114.719 -173.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 43.5 t 47.18 45.88 16.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.923 1.689 . . . . 0.0 112.69 -170.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 157.33 21.82 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.876 1.27 . . . . 0.0 111.656 167.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -63.87 -34.22 77.45 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.659 1.184 . . . . 0.0 113.993 -171.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 9.7 ptmm? -163.04 158.9 22.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.069 1.748 . . . . 0.0 111.77 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -134.02 122.33 22.86 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.638 1.175 . . . . 0.0 110.105 173.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -88.16 92.73 9.26 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.149 0.579 . . . . 0.0 110.047 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -78.66 126.05 30.2 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.884 -0.51 . . . . 0.0 111.253 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -99.12 115.57 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.833 1.253 . . . . 0.0 108.091 171.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -88.68 87.37 7.23 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.904 -0.497 . . . . 0.0 110.005 167.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.8 t -151.39 171.07 18.07 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.267 1.027 . . . . 0.0 112.998 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.6 mtp-105 -74.64 163.62 67.01 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 126.376 1.871 . . . . 0.0 110.934 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.84 -24.08 25.13 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.24 1.96 . . . . 0.0 114.393 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.54 -57.12 27.08 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.92 1.288 . . . . 0.0 112.95 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.37 -1.06 8.36 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.194 2.596 . . . . 0.0 114.602 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -99.72 -54.62 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 126.291 1.836 . . . . 0.0 109.665 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -44.96 77.61 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.41 -0.806 . . . . 0.0 112.843 -178.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.76 -4.11 38.64 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -172.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.4 mt -53.72 -35.56 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.702 0.801 . . . . 0.0 110.654 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.69 157.84 19.29 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.842 1.257 . . . . 0.0 113.196 172.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -155.45 109.26 2.83 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.985 1.714 . . . . 0.0 110.373 177.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.05 2.41 88.25 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.57 1.081 . . . . 0.0 114.909 -178.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.9 mt -76.23 118.92 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.752 1.221 . . . . 0.0 111.223 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -113.27 -9.7 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 126.887 2.075 . . . . 0.0 110.863 173.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.4 7.72 3.34 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.517 2.327 . . . . 0.0 116.01 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 79.4 p 50.24 61.8 3.01 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.711 1.605 . . . . 0.0 113.909 -173.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -156.14 155.99 33.47 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.576 1.551 . . . . 0.0 110.952 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -138.65 -171.81 3.15 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.959 -1.088 . . . . 0.0 111.106 166.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.4 t -124.87 142.34 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.294 1.437 . . . . 0.0 108.583 173.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.1 tp -47.97 137.4 10.19 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.241 1.016 . . . . 0.0 111.99 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.88 171.95 1.93 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.618 0.767 . . . . 0.0 112.293 175.041 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.6 t -118.27 -25.61 6.54 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.401 1.081 . . . . 0.0 113.835 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.1 m -82.4 169.81 16.01 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.655 1.182 . . . . 0.0 111.989 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -116.76 103.56 10.47 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.281 1.032 . . . . 0.0 111.4 -175.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -98.33 162.12 13.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.75 1.62 . . . . 0.0 110.96 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.64 105.81 4.41 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.918 -0.489 . . . . 0.0 110.122 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -97.93 124.62 42.45 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.615 1.166 . . . . 0.0 111.642 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.1 t -125.62 95.08 4.32 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 125.647 1.579 . . . . 0.0 110.05 -172.156 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.97 138.65 31.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.961 1.304 . . . . 0.0 110.506 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 43.3 m -113.32 151.4 31.24 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.95 -1.094 . . . . 0.0 108.481 161.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -135.57 123.65 22.91 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.811 0.844 . . . . 0.0 109.391 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.1 t -57.05 146.23 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.648 0.779 . . . . 0.0 111.483 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -135.65 103.63 5.5 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.235 1.014 . . . . 0.0 111.666 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.253 1.285 0 C-N-CA 126.693 1.997 . . . . 0.0 111.426 179.671 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo . . . . . 0 CA--C 1.538 0.716 0 N-CA-C 113.305 0.463 . . . . 0.0 113.305 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.4 m -136.92 -167.89 2.17 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.692 2.397 . . . . 0.0 109.352 175.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.12 146.97 43.76 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.565 1.146 . . . . 0.0 109.327 168.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -141.51 161.31 38.22 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.456 1.502 . . . . 0.0 110.423 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -105.42 158.04 16.93 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.031 1.332 . . . . 0.0 113.766 177.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.72 110.9 18.17 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.701 2.0 . . . . 0.0 111.466 -171.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -134.98 98.43 4.01 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.086 1.354 . . . . 0.0 112.234 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -116.5 137.27 52.3 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.398 1.479 . . . . 0.0 111.171 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 72.9 m -145.94 167.44 23.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.141 1.776 . . . . 0.0 111.027 -175.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 m -140.3 104.53 4.81 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.289 -0.882 . . . . 0.0 111.24 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -171.86 171.82 5.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.937 1.295 . . . . 0.0 113.252 -170.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.458 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -62.98 172.73 1.62 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 128.788 2.835 . . . . 0.0 113.658 168.94 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -143.46 145.33 32.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.569 1.948 . . . . 0.0 111.643 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.3 t -105.36 139.33 40.16 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.023 0.929 . . . . 0.0 111.277 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.523 HG23 HD22 ' A' ' 104' ' ' ASN . 15.9 m -146.88 -178.93 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.306 1.842 . . . . 0.0 111.335 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.2 m -127.03 116.02 20.09 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.688 1.195 . . . . 0.0 111.552 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -85.45 131.57 34.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.345 0.658 . . . . 0.0 111.616 173.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.84 115.45 10.62 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.22 1.408 . . . . 0.0 108.55 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.5 m120 58.6 54.98 5.05 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.958 1.303 . . . . 0.0 112.335 -170.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 65.03 25.54 12.63 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.493 2.317 . . . . 0.0 115.077 169.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.6 133.08 5.73 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.962 1.305 . . . . 0.0 109.653 -175.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -75.91 108.55 2.71 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.803 3.002 . . . . 0.0 112.984 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.483 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.8 m -111.01 15.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 126.169 1.788 . . . . 0.0 113.044 -178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.4 143.67 24.07 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.139 1.336 . . . . 0.0 111.086 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -102.39 126.78 49.52 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.677 1.191 . . . . 0.0 111.407 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.6 t -101.68 -56.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.903 0.881 . . . . 0.0 111.852 -178.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.27 -171.78 41.15 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 -170.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 t -131.26 120.39 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.005 1.722 . . . . 0.0 110.168 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.27 2.29 25.34 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.579 0.992 . . . . 0.0 115.579 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.4 p -170.28 166.86 8.68 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.895 2.478 . . . . 0.0 111.079 -176.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.8 m . . . . . 0 CA--C 1.544 0.716 0 C-N-CA 125.539 1.536 . . . . 0.0 110.996 173.486 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.9 t70 . . . . . 0 CA--C 1.54 0.578 0 CA-C-O 121.688 0.756 . . . . 0.0 109.279 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.483 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.0 t-105 -54.19 -36.97 63.99 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.585 1.554 . . . . 0.0 112.293 166.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -44.41 92.02 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.901 0.881 . . . . 0.0 111.491 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.6 p -84.97 -26.05 27.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.297 1.039 . . . . 0.0 113.771 176.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -52.47 -42.3 64.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.785 1.634 . . . . 0.0 112.996 173.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -57.62 -62.54 1.72 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.056 0.942 . . . . 0.0 110.475 172.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.22 -22.13 50.73 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -67.65 -55.23 14.09 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.186 1.795 . . . . 0.0 112.44 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -146.52 22.27 1.31 Allowed 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -173.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -126.78 147.84 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 O-C-N 120.473 -1.392 . . . . 0.0 109.006 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.8 t -143.05 152.08 41.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -83.27 -1.5 53.32 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.838 1.655 . . . . 0.0 112.779 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.9 t -163.26 107.48 1.05 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.204 1.802 . . . . 0.0 111.429 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -67.92 110.54 3.91 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.376 -1.453 . . . . 0.0 110.42 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -129.33 7.71 5.42 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.603 1.561 . . . . 0.0 113.088 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.5 t -75.68 141.35 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.804 1.241 . . . . 0.0 111.983 -172.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -126.3 4.99 7.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.075 1.75 . . . . 0.0 113.437 -178.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.0 m 55.07 40.12 31.8 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 126.957 2.103 . . . . 0.0 114.26 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -152.16 -26.23 0.18 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.084 2.154 . . . . 0.0 113.432 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -99.61 -5.24 29.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.63 1.172 . . . . 0.0 113.482 176.279 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -64.53 -5.07 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.939 1.296 . . . . 0.0 114.435 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -53.5 -25.93 18.66 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 160.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.3 t -97.54 -15.84 20.35 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.708 1.603 . . . . 0.0 113.844 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 49.3 p -94.75 -179.81 4.99 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.014 1.326 . . . . 0.0 110.94 175.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -68.43 -11.19 59.35 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -85.52 12.54 8.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.548 2.339 . . . . 0.0 114.811 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 36.5 p90 -67.21 -8.77 34.06 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.061 2.144 . . . . 0.0 114.76 -171.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -62.59 -6.64 3.67 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.445 2.298 . . . . 0.0 115.384 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.0 t 40.55 56.02 2.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.513 1.925 . . . . 0.0 112.949 -165.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 158.87 28.17 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.223 1.409 . . . . 0.0 111.61 167.344 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.82 -35.48 80.8 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -172.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -160.4 156.53 26.27 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.097 1.759 . . . . 0.0 111.564 170.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -131.34 129.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.775 1.23 . . . . 0.0 109.61 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.0 m -96.83 93.84 6.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.691 0.796 . . . . 0.0 109.68 177.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -77.89 127.86 33.04 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.529 0.732 . . . . 0.0 111.394 175.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.6 mt -105.77 114.2 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.985 1.714 . . . . 0.0 107.901 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -86.35 84.2 7.51 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.822 -0.549 . . . . 0.0 110.479 170.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.8 m -141.88 158.29 43.97 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.611 1.565 . . . . 0.0 112.665 178.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -72.41 161.48 78.86 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.898 1.279 . . . . 0.0 110.762 164.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.8 -21.58 28.47 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.401 2.067 . . . . 0.0 114.375 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -61.5 -58.11 20.7 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 119.551 1.069 . . . . 0.0 112.572 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.37 0.41 5.39 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.148 2.565 . . . . 0.0 115.039 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -103.61 -54.96 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.336 1.854 . . . . 0.0 109.747 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -44.47 78.88 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.112 -0.993 . . . . 0.0 112.884 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.11 32.98 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.509 1.299 . . . . 0.0 114.509 -173.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.2 mt -52.61 -35.95 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.622 0.769 . . . . 0.0 110.645 169.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.8 p -109.8 159.99 16.72 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.286 1.034 . . . . 0.0 113.277 174.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 tptp -155.11 107.2 2.68 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.694 1.598 . . . . 0.0 110.567 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 6.29 88.67 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.275 0.941 . . . . 0.0 114.898 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.1 mt -76.56 115.39 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.518 1.159 . . . . 0.0 110.952 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 mt -112.33 -10.59 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 126.833 2.053 . . . . 0.0 110.893 173.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.96 3.79 6.32 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.406 2.282 . . . . 0.0 115.72 -173.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.1 t 53.44 66.2 1.3 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.819 1.647 . . . . 0.0 113.013 -173.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -156.46 160.53 39.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.281 1.832 . . . . 0.0 111.298 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.523 HD22 HG23 ' A' ' 16' ' ' VAL . 5.7 t-20 -142.31 -169.73 3.02 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.693 -1.254 . . . . 0.0 111.733 164.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.5 t -125.08 139.68 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.652 1.581 . . . . 0.0 108.783 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.9 tp -49.53 139.71 11.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.743 1.217 . . . . 0.0 111.836 170.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.1 172.28 1.47 Allowed 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 174.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.1 t -122.49 -30.36 3.94 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.93 1.292 . . . . 0.0 113.802 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.5 m -75.63 169.89 17.23 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.546 1.138 . . . . 0.0 111.648 171.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -123.7 105.03 9.36 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.991 0.916 . . . . 0.0 111.524 -173.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -100.28 163.76 12.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.622 1.969 . . . . 0.0 110.835 -171.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -73.86 104.16 4.64 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.724 -0.61 . . . . 0.0 110.411 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.07 131.0 44.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.089 1.355 . . . . 0.0 111.892 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.6 t -135.84 96.8 3.49 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.156 1.382 . . . . 0.0 110.801 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -93.6 155.03 17.52 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.706 0.765 . . . . 0.0 111.77 171.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.08 99.24 3.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.594 0.757 . . . . 0.0 110.979 171.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -86.59 133.05 33.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.74 1.216 . . . . 0.0 111.2 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.98 147.79 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 C-N-CA 125.075 1.35 . . . . 0.0 111.933 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 76.5 p -120.89 96.21 5.02 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.065 1.346 . . . . 0.0 111.536 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.456 1.502 . . . . 0.0 112.762 176.479 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.539 0.746 0 N-CA-C 112.881 0.3 . . . . 0.0 112.881 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.0 m -141.63 168.33 20.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.157 2.183 . . . . 0.0 110.064 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -87.97 137.55 32.23 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.767 1.227 . . . . 0.0 109.997 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -137.17 160.86 37.77 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.694 1.198 . . . . 0.0 112.29 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -96.15 155.31 16.81 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.635 2.374 . . . . 0.0 111.447 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tp -80.34 127.89 32.92 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.674 1.19 . . . . 0.0 111.352 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -147.33 96.86 2.77 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.335 1.454 . . . . 0.0 112.006 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 mmtm -100.55 149.12 24.05 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.193 1.397 . . . . 0.0 111.208 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 29.6 m -155.89 169.0 25.44 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.203 1.801 . . . . 0.0 111.152 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 m -141.17 105.27 4.79 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.293 -0.88 . . . . 0.0 110.867 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -170.28 172.09 6.39 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.778 1.231 . . . . 0.0 113.652 -171.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.78 174.24 0.63 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 128.241 2.616 . . . . 0.0 114.515 168.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.79 143.77 31.5 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.878 2.071 . . . . 0.0 111.702 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 t -102.99 140.23 37.52 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.569 1.148 . . . . 0.0 111.095 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.527 HG23 HD22 ' A' ' 104' ' ' ASN . 15.8 m -147.18 -179.94 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 125.926 1.69 . . . . 0.0 111.711 -175.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 m -125.56 117.78 24.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.828 1.251 . . . . 0.0 111.583 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.81 131.52 34.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.625 0.77 . . . . 0.0 111.517 173.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -135.21 115.93 13.89 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.69 1.596 . . . . 0.0 108.437 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.5 m120 56.47 55.82 6.2 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.688 1.195 . . . . 0.0 112.416 -171.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.59 24.83 11.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.551 2.34 . . . . 0.0 114.936 169.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -155.54 131.26 5.51 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.485 1.114 . . . . 0.0 109.567 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -76.29 102.32 1.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.975 3.116 . . . . 0.0 112.046 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.404 HG12 ' H ' ' A' ' 51' ' ' TRP . 14.7 m -90.44 -10.21 10.23 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.583 0 CA-C-O 117.728 -1.129 . . . . 0.0 112.494 -179.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -138.58 133.3 32.33 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.657 1.571 . . . . 0.0 111.041 -163.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -82.93 144.81 29.77 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.288 0.495 . . . . 0.0 110.168 171.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -116.31 -51.78 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.831 0.853 . . . . 0.0 111.652 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.81 -177.23 47.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 123.564 0.602 . . . . 0.0 113.018 -176.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -124.56 133.3 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.522 1.129 . . . . 0.0 111.494 -174.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.7 -6.58 6.11 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.551 1.072 . . . . 0.0 115.616 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -173.6 169.04 4.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.538 3.135 . . . . 0.0 109.201 -168.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.6 m . . . . . 0 CA--C 1.539 0.546 0 C-N-CA 125.592 1.557 . . . . 0.0 110.683 173.16 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 122.554 1.169 . . . . 0.0 111.889 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.404 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.6 t-105 -50.27 -37.25 35.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.044 1.738 . . . . 0.0 111.813 162.23 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -27.21 64.48 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.471 1.508 . . . . 0.0 113.019 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.2 p -106.78 -20.5 13.32 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.837 1.655 . . . . 0.0 113.942 174.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -51.3 -40.97 60.14 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.136 1.774 . . . . 0.0 112.557 171.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -58.13 -65.21 0.68 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.779 1.232 . . . . 0.0 110.519 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.01 -21.76 63.9 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -177.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -63.14 -48.04 80.17 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.1 1.76 . . . . 0.0 113.674 174.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -154.39 21.25 0.48 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 115.759 1.762 . . . . 0.0 115.759 -175.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.5 mt -128.47 147.3 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.354 1.461 . . . . 0.0 109.386 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -144.71 154.48 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 176.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -86.63 0.44 54.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.076 1.75 . . . . 0.0 112.591 167.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.67 109.88 1.27 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.443 1.897 . . . . 0.0 111.279 176.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 ttp85 -66.96 104.49 1.39 Allowed 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.473 -1.392 . . . . 0.0 110.304 171.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -114.79 5.7 15.31 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.833 1.653 . . . . 0.0 112.677 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 85.7 t -81.73 139.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.241 1.016 . . . . 0.0 111.454 -173.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -126.37 8.07 7.11 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.201 1.8 . . . . 0.0 112.539 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 28.3 m 53.33 40.9 32.0 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.27 2.228 . . . . 0.0 113.487 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -153.16 -26.44 0.15 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 127.818 2.447 . . . . 0.0 112.851 178.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -99.43 -5.11 30.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.746 1.218 . . . . 0.0 113.808 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -63.98 -8.24 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.837 1.255 . . . . 0.0 114.136 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.2 tmm? -55.71 -31.01 62.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.152 0.981 . . . . 0.0 112.677 163.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.5 m -88.98 -9.16 52.44 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.572 1.549 . . . . 0.0 114.671 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.4 p -106.14 179.15 4.35 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.261 1.425 . . . . 0.0 111.218 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -65.61 -15.59 62.89 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.551 -1.343 . . . . 0.0 114.097 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.9 7.52 8.7 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 127.42 2.288 . . . . 0.0 114.694 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -63.79 -8.06 9.62 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.126 2.171 . . . . 0.0 115.093 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 58.7 t60 -61.29 -10.74 7.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.217 1.807 . . . . 0.0 114.796 -174.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.1 t 39.55 62.45 1.18 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.968 2.107 . . . . 0.0 113.249 -165.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 159.97 32.02 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.741 161.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.54 -31.32 72.32 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.36 1.464 . . . . 0.0 114.625 -171.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.6 ptmm? -160.4 156.49 26.22 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.576 1.55 . . . . 0.0 111.541 168.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -128.22 149.28 50.53 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.857 0.863 . . . . 0.0 110.231 168.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.9 m -115.33 91.8 3.72 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.049 0.94 . . . . 0.0 109.769 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -80.25 128.12 33.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.278 0.561 . . . . 0.0 111.266 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 82.6 mt -105.93 113.69 43.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.001 1.721 . . . . 0.0 107.432 176.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -84.24 89.08 7.27 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.676 -0.64 . . . . 0.0 110.022 168.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 64.3 p -149.07 164.49 34.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.511 1.124 . . . . 0.0 112.811 171.446 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -76.45 161.77 73.39 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.701 1.2 . . . . 0.0 110.611 171.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -68.99 -21.35 37.2 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.028 1.819 . . . . 0.0 114.563 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.95 -57.38 21.67 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 119.483 1.038 . . . . 0.0 113.015 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.2 -0.46 5.69 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.446 2.764 . . . . 0.0 115.157 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -101.41 -56.42 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 109.577 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.04 -43.76 86.62 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.229 -0.919 . . . . 0.0 113.031 -179.166 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.93 -3.28 34.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 64.5 mt -53.5 -35.8 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.529 0.732 . . . . 0.0 110.615 170.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.0 p -109.02 159.26 16.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.284 1.034 . . . . 0.0 113.262 174.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -153.91 102.07 2.48 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.845 1.658 . . . . 0.0 110.577 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.85 5.47 87.91 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.175 0.893 . . . . 0.0 114.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.8 mt -73.82 115.68 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-N 118.635 1.217 . . . . 0.0 111.177 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -109.42 -12.1 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 126.614 1.966 . . . . 0.0 110.809 171.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.15 5.68 4.18 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.477 2.311 . . . . 0.0 116.217 -170.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.0 t 52.38 64.87 1.69 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.446 1.498 . . . . 0.0 112.741 -173.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -156.13 158.05 37.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 126.279 1.832 . . . . 0.0 111.058 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.527 HD22 HG23 ' A' ' 16' ' ' VAL . 6.0 t-20 -144.34 -169.59 3.17 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.747 -1.22 . . . . 0.0 111.839 163.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.84 141.37 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 125.681 1.592 . . . . 0.0 108.735 171.239 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.2 tp -50.73 141.6 12.69 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.682 1.193 . . . . 0.0 111.889 170.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.58 171.49 1.98 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 173.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -122.4 -20.46 6.09 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.804 1.242 . . . . 0.0 114.017 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 41.1 m -83.96 170.37 14.06 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.07 1.348 . . . . 0.0 111.63 174.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -117.57 106.02 12.68 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.576 1.151 . . . . 0.0 111.023 -178.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -98.93 159.2 15.12 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.714 1.606 . . . . 0.0 110.341 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -70.52 106.94 3.63 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.944 -0.472 . . . . 0.0 110.232 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.48 132.31 44.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.952 1.301 . . . . 0.0 111.789 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.4 t -136.11 93.57 2.93 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.746 1.219 . . . . 0.0 109.87 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.8 159.28 17.82 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.733 0.813 . . . . 0.0 110.488 171.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.07 139.79 29.13 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.257 1.023 . . . . 0.0 109.371 161.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -124.13 125.94 45.34 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.545 1.138 . . . . 0.0 110.573 -174.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.07 145.34 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.561 0.744 . . . . 0.0 111.634 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.2 t -135.9 105.69 6.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.471 1.108 . . . . 0.0 111.453 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.6 t . . . . . 0 C--O 1.254 1.33 0 C-N-CA 126.539 1.936 . . . . 0.0 111.56 -179.402 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo . . . . . 0 CA--C 1.544 0.982 0 N-CA-C 114.126 0.779 . . . . 0.0 114.126 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 m -135.18 165.97 24.18 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.804 2.042 . . . . 0.0 109.817 171.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.549 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.6 mmpt? -95.34 142.74 27.37 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.942 0.897 . . . . 0.0 110.983 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -136.91 156.14 48.85 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.509 1.524 . . . . 0.0 110.995 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.97 151.64 19.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.17 1.388 . . . . 0.0 112.302 172.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.6 110.31 16.85 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.743 2.017 . . . . 0.0 111.372 -174.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -130.36 116.97 19.04 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.544 1.537 . . . . 0.0 111.466 175.1 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -130.35 150.43 51.59 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.968 1.707 . . . . 0.0 110.835 174.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.8 m -156.69 173.9 16.27 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.198 1.799 . . . . 0.0 111.43 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -144.27 101.49 3.71 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.067 -1.021 . . . . 0.0 110.861 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 20.8 p-10 -166.13 175.8 8.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.192 1.397 . . . . 0.0 113.108 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.417 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -65.21 170.02 5.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.162 2.585 . . . . 0.0 113.276 172.545 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -140.37 143.76 35.89 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.736 1.614 . . . . 0.0 111.811 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.7 t -102.21 143.99 31.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.916 0.865 . . . . 0.0 111.232 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -147.5 -178.05 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.455 1.902 . . . . 0.0 111.597 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.3 m -126.91 115.4 19.22 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.768 1.227 . . . . 0.0 111.612 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.9 t -83.29 129.87 35.03 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.113 0.965 . . . . 0.0 111.497 176.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.11 113.0 8.13 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.51 1.124 . . . . 0.0 108.538 177.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.7 59.46 3.22 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.522 1.529 . . . . 0.0 113.025 -169.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 62.84 26.46 15.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.599 2.359 . . . . 0.0 114.8 169.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.43 134.7 5.8 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 125.317 1.447 . . . . 0.0 109.559 -176.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.41 107.97 2.6 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.644 2.896 . . . . 0.0 113.072 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.446 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.9 m -108.31 17.58 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.777 2.031 . . . . 0.0 112.603 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -153.27 140.53 19.52 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.137 1.335 . . . . 0.0 110.589 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -86.07 148.2 25.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.928 0.491 . . . . 0.0 110.387 170.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.4 t -119.0 -58.8 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 123.675 0.79 . . . . 0.0 111.771 173.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.86 -172.3 42.18 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-N 118.537 0.608 . . . . 0.0 114.089 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.2 t -128.77 123.99 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.179 1.392 . . . . 0.0 109.891 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.3 3.49 25.2 Favored Glycine 0 CA--C 1.541 1.713 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -175.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 99.0 p -165.87 164.89 18.55 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.15 2.18 . . . . 0.0 111.42 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 93.1 m . . . . . 0 CA--C 1.54 0.575 0 C-N-CA 125.631 1.572 . . . . 0.0 110.611 171.942 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 CA--C 1.542 0.643 0 CA-C-O 121.989 0.899 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.446 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.2 t-105 -55.07 -36.64 65.83 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.142 1.777 . . . . 0.0 112.185 169.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.88 -37.34 76.35 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.866 1.266 . . . . 0.0 112.195 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 p -89.47 -27.91 20.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.542 1.137 . . . . 0.0 113.521 174.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -52.05 -44.4 64.25 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.787 1.635 . . . . 0.0 113.067 174.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -56.02 -63.06 1.3 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -60.36 -20.01 57.83 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -70.11 -46.87 63.9 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.123 1.369 . . . . 0.0 113.311 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -153.04 23.65 0.56 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -176.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.4 mt -128.62 147.8 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 120.147 -1.596 . . . . 0.0 109.299 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -147.78 155.68 41.94 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 177.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.07 2.31 54.27 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.255 1.822 . . . . 0.0 112.814 167.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.1 t -160.18 114.41 2.22 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.185 1.794 . . . . 0.0 111.23 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.9 ttp-105 -66.47 103.21 1.0 Allowed 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.669 -1.27 . . . . 0.0 110.45 172.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -112.83 2.89 16.12 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.059 1.344 . . . . 0.0 113.45 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.419 HG22 ' H ' ' A' ' 67' ' ' CYS . 8.2 p -75.54 145.06 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.355 1.062 . . . . 0.0 112.398 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -130.32 8.08 5.03 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.112 1.765 . . . . 0.0 112.703 172.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.419 ' H ' HG22 ' A' ' 65' ' ' VAL . 21.4 m 48.37 50.85 16.04 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.895 2.478 . . . . 0.0 113.238 -176.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.43 -17.01 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.366 2.266 . . . . 0.0 113.202 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -110.26 -2.99 16.49 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.936 1.695 . . . . 0.0 113.767 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -63.98 -8.66 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.637 1.575 . . . . 0.0 113.913 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 ppp? -53.01 -22.51 5.83 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.8 t -98.07 -21.26 16.88 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.487 1.515 . . . . 0.0 113.995 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.1 p -87.35 -177.7 6.01 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 111.849 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -63.22 -20.53 65.51 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.832 -1.168 . . . . 0.0 113.646 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.79 21.81 3.39 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.569 1.948 . . . . 0.0 113.326 -175.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -63.6 -7.03 6.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 126.092 1.757 . . . . 0.0 114.663 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 66.0 t60 -64.7 -6.46 7.92 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.583 1.553 . . . . 0.0 114.653 -177.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.31 33.6 18.72 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.187 1.795 . . . . 0.0 114.476 -177.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 158.18 3.52 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.061 1.745 . . . . 0.0 113.926 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.04 -35.69 81.07 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.435 1.494 . . . . 0.0 114.877 -173.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -161.18 163.44 31.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.185 1.394 . . . . 0.0 112.774 165.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -131.63 166.18 22.02 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.979 0.912 . . . . 0.0 111.336 166.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.0 m -126.73 93.84 3.89 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.734 1.214 . . . . 0.0 109.404 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -77.95 122.64 25.78 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.259 0.624 . . . . 0.0 110.759 174.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -98.64 114.52 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.954 1.302 . . . . 0.0 107.848 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -87.02 86.1 7.29 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.386 0.612 . . . . 0.0 110.122 167.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.5 p -145.87 166.66 25.31 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.897 1.279 . . . . 0.0 112.205 168.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -73.29 164.47 60.73 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.406 1.082 . . . . 0.0 111.325 168.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.91 -23.19 25.83 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.747 2.298 . . . . 0.0 114.521 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -59.57 -58.49 19.09 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.61 1.164 . . . . 0.0 112.806 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.56 0.73 5.08 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.307 2.671 . . . . 0.0 114.926 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.6 t -103.3 -55.57 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 126.604 1.962 . . . . 0.0 109.82 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -43.07 85.11 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.208 -0.933 . . . . 0.0 112.769 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.64 -5.58 46.18 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -173.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.5 mt -53.49 -36.01 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.598 0.759 . . . . 0.0 110.58 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 p -111.5 158.44 19.16 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.805 1.242 . . . . 0.0 113.057 173.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -155.77 105.97 2.44 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.742 1.617 . . . . 0.0 110.579 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.35 5.62 86.94 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 123.984 0.802 . . . . 0.0 114.733 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.4 mt -77.45 116.53 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.676 1.19 . . . . 0.0 110.87 -178.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 7.5 mt -111.33 -12.52 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 126.768 2.027 . . . . 0.0 110.879 175.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.32 7.67 2.68 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 127.633 2.373 . . . . 0.0 116.095 -170.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.9 t 49.69 66.11 1.22 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.996 1.318 . . . . 0.0 113.276 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.1 tttt -159.37 157.46 30.39 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.352 1.461 . . . . 0.0 111.356 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -145.01 -169.11 3.11 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.576 -1.327 . . . . 0.0 112.067 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 16.8 t -125.74 143.2 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 126.127 1.771 . . . . 0.0 108.865 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.5 tp -50.78 141.91 12.32 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.559 1.143 . . . . 0.0 111.982 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.94 172.9 1.53 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 8.8 t -120.37 -28.85 4.93 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.799 1.24 . . . . 0.0 113.573 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.9 m -76.96 171.7 14.37 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.419 1.488 . . . . 0.0 111.845 173.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -123.04 110.4 15.29 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.118 0.967 . . . . 0.0 111.144 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -105.98 159.67 15.87 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.157 1.783 . . . . 0.0 110.245 -171.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.64 109.54 4.38 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.337 0.589 . . . . 0.0 110.513 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.03 123.18 44.81 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.283 1.433 . . . . 0.0 111.231 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.9 t -126.71 93.61 3.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.436 1.494 . . . . 0.0 110.686 -173.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.02 163.45 16.28 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.463 0.649 . . . . 0.0 110.329 173.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.96 138.77 19.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 158.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -126.74 134.6 50.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.931 1.292 . . . . 0.0 109.271 -175.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 29.2 t -60.9 149.93 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 123.556 0.742 . . . . 0.0 111.816 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -134.52 106.64 7.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.22 1.408 . . . . 0.0 110.933 171.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.253 1.262 0 C-N-CA 126.244 1.818 . . . . 0.0 112.602 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 CA--C 1.54 0.825 0 N-CA-C 111.521 -0.223 . . . . 0.0 111.521 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -145.84 179.28 7.57 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.61 2.364 . . . . 0.0 109.574 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -110.16 131.16 55.31 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.644 1.178 . . . . 0.0 110.733 -177.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.84 161.94 33.79 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.222 1.409 . . . . 0.0 111.924 -176.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -107.55 151.13 26.01 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.002 1.721 . . . . 0.0 112.764 177.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.74 113.36 16.75 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.555 1.942 . . . . 0.0 111.487 -172.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -139.55 109.45 6.36 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.39 1.476 . . . . 0.0 111.883 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -118.12 153.81 33.17 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.417 1.487 . . . . 0.0 111.637 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.0 m -156.21 172.19 18.89 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.17 1.788 . . . . 0.0 111.557 175.174 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 m -141.26 104.91 4.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.869 0.868 . . . . 0.0 110.569 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -169.42 172.43 7.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.682 1.193 . . . . 0.0 113.664 -170.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.79 174.28 0.85 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.271 2.628 . . . . 0.0 114.397 167.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.01 147.06 32.21 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.682 1.993 . . . . 0.0 111.726 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 t -108.37 134.94 50.48 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.869 1.268 . . . . 0.0 111.404 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.3 m -141.79 -178.68 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.935 1.694 . . . . 0.0 111.707 -173.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.431 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.1 m -129.86 115.04 16.66 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.457 -0.777 . . . . 0.0 111.785 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.3 t -83.0 128.54 34.57 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.53 1.132 . . . . 0.0 111.254 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.23 112.16 8.42 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.682 1.193 . . . . 0.0 108.45 177.428 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 56.05 60.52 3.18 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.61 1.564 . . . . 0.0 112.968 -169.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.46 27.06 15.08 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.719 2.408 . . . . 0.0 114.751 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.17 133.8 5.45 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 109.519 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -75.86 105.12 2.02 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.809 3.006 . . . . 0.0 112.137 177.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 m -97.84 14.33 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.834 1.254 . . . . 0.0 111.997 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.431 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 24.7 t-80 -158.42 147.73 19.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.328 1.422 . . . . 0.0 113.025 -167.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -108.77 128.0 54.5 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.007 1.323 . . . . 0.0 111.009 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.4 t -93.66 -58.24 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.027 0.931 . . . . 0.0 110.97 174.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.77 -175.58 46.62 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.448 1.023 . . . . 0.0 112.652 -172.584 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.9 p -122.79 136.86 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.43 1.092 . . . . 0.0 111.84 -172.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.96 -5.36 3.67 Favored Glycine 0 CA--C 1.541 1.714 0 N-CA-C 116.2 1.24 . . . . 0.0 116.2 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -172.5 165.46 5.65 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 129.929 3.292 . . . . 0.0 109.527 -171.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 83.9 m . . . . . 0 CA--C 1.542 0.653 0 C-N-CA 125.042 1.337 . . . . 0.0 110.427 173.7 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 . . . . . 0 CA--C 1.543 0.711 0 CA-C-O 123.026 1.393 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -56.78 -36.99 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.186 2.194 . . . . 0.0 112.215 167.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.47 90.4 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.699 1.2 . . . . 0.0 111.587 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.6 p -82.93 -29.3 29.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.099 1.36 . . . . 0.0 113.532 174.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.56 -43.87 65.5 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.389 1.476 . . . . 0.0 112.699 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.12 -61.58 2.36 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.12 0.968 . . . . 0.0 110.536 173.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.66 -19.86 52.27 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -178.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -70.32 -48.44 56.52 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.764 1.626 . . . . 0.0 112.986 175.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -152.34 22.85 0.63 Allowed 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.8 mt -128.08 144.16 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 120.439 -1.413 . . . . 0.0 109.534 178.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.4 t -143.36 156.39 44.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 178.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -91.42 0.83 57.46 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.396 1.878 . . . . 0.0 112.487 167.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.3 t -162.8 112.29 1.38 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.338 1.855 . . . . 0.0 111.185 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.8 ttp-105 -68.0 107.34 2.65 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.545 -1.347 . . . . 0.0 110.673 173.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.47 1.57 13.68 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.142 1.377 . . . . 0.0 113.687 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.0 p -69.92 142.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.07 1.348 . . . . 0.0 112.516 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -130.96 12.16 5.17 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.268 1.827 . . . . 0.0 112.424 169.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.9 m 51.48 40.93 27.9 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.034 2.534 . . . . 0.0 113.152 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -153.25 -38.68 0.1 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.379 2.271 . . . . 0.0 111.362 -174.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -90.97 -8.3 49.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.369 1.067 . . . . 0.0 113.493 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.0 pt -62.15 -10.59 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.347 1.059 . . . . 0.0 113.721 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.83 -36.04 35.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.82 1.648 . . . . 0.0 113.451 166.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 96.0 p -87.3 -14.5 40.68 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 177.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.6 p -86.17 -178.84 6.61 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.221 1.408 . . . . 0.0 111.869 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -70.88 -12.43 61.54 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -85.93 10.02 15.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.031 2.132 . . . . 0.0 114.989 -176.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -67.49 -7.49 26.07 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 127.978 2.511 . . . . 0.0 114.605 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -61.79 0.54 0.35 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.237 2.615 . . . . 0.0 115.846 -174.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.6 t 56.15 30.96 17.38 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.233 1.813 . . . . 0.0 114.2 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.57 154.85 27.63 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.973 1.309 . . . . 0.0 112.616 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -63.96 -33.72 76.36 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.922 1.289 . . . . 0.0 114.322 -169.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.3 pttm -162.01 163.79 28.66 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.559 1.544 . . . . 0.0 111.901 166.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -132.94 159.31 40.34 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.574 0.749 . . . . 0.0 110.674 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.0 m -122.73 90.41 3.29 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.363 1.065 . . . . 0.0 110.332 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -77.42 119.93 21.72 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.638 0.775 . . . . 0.0 111.134 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.6 mt -96.08 112.92 29.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 125.645 1.578 . . . . 0.0 107.65 173.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -80.5 89.61 5.64 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.532 -0.73 . . . . 0.0 109.783 167.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.0 m -149.0 159.2 44.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.56 1.144 . . . . 0.0 112.981 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 25.8 mtt-85 -71.14 163.79 62.55 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 124.575 1.15 . . . . 0.0 111.115 164.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.59 -24.2 30.69 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 122.301 2.0 . . . . 0.0 114.201 176.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.61 -56.37 30.35 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 117.921 -1.038 . . . . 0.0 113.091 -175.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.79 -0.39 6.87 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.983 2.455 . . . . 0.0 114.826 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -102.9 -54.44 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.323 1.849 . . . . 0.0 109.749 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -45.53 78.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.209 -0.932 . . . . 0.0 112.848 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.56 35.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -172.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.09 -35.68 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 123.642 0.777 . . . . 0.0 110.599 169.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.3 p -111.07 157.42 20.0 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.864 1.266 . . . . 0.0 113.217 172.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -155.37 106.25 2.54 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.583 1.953 . . . . 0.0 109.875 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.6 3.24 86.49 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.39 0.995 . . . . 0.0 114.754 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.2 mt -76.12 116.05 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.706 1.202 . . . . 0.0 110.86 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 17.9 mt -105.54 -18.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 126.447 1.899 . . . . 0.0 110.807 173.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.12 8.87 1.12 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 128.095 2.558 . . . . 0.0 116.909 -166.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 8.7 t 50.7 62.08 2.89 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.895 1.225 . . . . 0.0 113.48 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -157.55 154.62 28.87 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 125.919 1.687 . . . . 0.0 111.242 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -138.09 -170.54 2.82 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.869 -1.145 . . . . 0.0 111.534 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.85 141.92 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 125.75 1.62 . . . . 0.0 108.524 173.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.6 tp -51.01 140.96 14.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.29 1.036 . . . . 0.0 111.72 169.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.58 170.85 2.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 122.583 1.183 . . . . 0.0 113.508 172.193 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.8 p -118.26 -30.89 5.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.567 1.947 . . . . 0.0 113.353 -176.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.5 m -80.52 171.08 15.5 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.711 1.604 . . . . 0.0 112.086 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -118.48 110.09 17.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.796 1.238 . . . . 0.0 111.164 -176.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -104.75 161.08 14.47 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.809 1.644 . . . . 0.0 110.374 -173.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -71.47 109.14 5.25 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.876 -0.515 . . . . 0.0 110.417 -179.538 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.28 126.62 48.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.668 1.187 . . . . 0.0 112.003 -176.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 30.1 t -128.76 91.48 3.23 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.326 1.45 . . . . 0.0 109.855 -174.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -82.21 161.85 22.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.851 0.834 . . . . 0.0 110.407 169.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.58 128.73 11.15 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.04 -1.037 . . . . 0.0 109.484 157.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -116.96 136.87 52.61 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.406 1.083 . . . . 0.0 110.114 -173.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 20.6 t -60.5 147.35 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-O 121.451 0.643 . . . . 0.0 112.043 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.8 t -137.64 101.8 4.58 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.049 1.34 . . . . 0.0 111.269 172.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.0 p . . . . . 0 C--O 1.254 1.305 0 C-N-CA 126.591 1.956 . . . . 0.0 114.403 178.93 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 CA--C 1.539 0.76 0 N-CA-C 113.522 0.547 . . . . 0.0 113.522 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.68 -167.34 2.11 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.752 2.421 . . . . 0.0 109.217 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.12 149.41 42.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.736 1.214 . . . . 0.0 109.845 167.427 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -142.73 159.08 42.93 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.888 1.675 . . . . 0.0 110.213 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -99.11 157.21 16.51 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.481 1.112 . . . . 0.0 113.061 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.95 103.35 14.59 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.367 1.467 . . . . 0.0 111.093 -169.307 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -127.98 114.72 17.49 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.457 1.503 . . . . 0.0 111.118 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -130.86 147.67 52.54 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.05 1.74 . . . . 0.0 110.865 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.6 t -151.11 170.3 19.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.842 1.657 . . . . 0.0 110.987 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.4 m -139.7 100.86 4.06 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.479 -0.763 . . . . 0.0 110.768 173.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.93 176.74 9.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.833 1.253 . . . . 0.0 113.519 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.25 170.3 3.87 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.471 2.308 . . . . 0.0 113.608 171.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.9 p90 -141.15 142.18 34.08 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.122 1.769 . . . . 0.0 111.541 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.5 t -100.52 142.71 31.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.801 0.81 . . . . 0.0 111.413 174.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.483 HG23 HD22 ' A' ' 104' ' ' ASN . 16.8 m -147.24 -178.3 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 126.564 1.945 . . . . 0.0 110.983 -178.015 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -126.49 117.37 22.74 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.93 1.292 . . . . 0.0 111.532 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -87.1 133.0 33.66 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.658 0.783 . . . . 0.0 111.704 174.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -139.89 113.63 8.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.261 1.425 . . . . 0.0 108.501 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 59.47 56.7 3.6 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.402 1.481 . . . . 0.0 112.416 -169.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.12 24.81 13.57 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.629 2.372 . . . . 0.0 115.1 169.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.1 132.7 5.32 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.855 1.262 . . . . 0.0 109.639 -174.341 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.45 109.05 2.79 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.565 2.843 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.453 HG12 ' N ' ' A' ' 51' ' ' TRP . 4.0 m -108.52 18.2 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.692 1.997 . . . . 0.0 112.518 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -156.51 137.31 13.37 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.659 -1.276 . . . . 0.0 110.826 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -80.69 153.82 27.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.056 0.389 . . . . 0.0 110.452 167.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.9 -54.54 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.216 1.006 . . . . 0.0 112.155 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.45 -172.28 43.43 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.259 0.936 . . . . 0.0 114.677 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -125.91 129.04 72.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 125.413 1.485 . . . . 0.0 109.99 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.17 -4.58 4.56 Favored Glycine 0 CA--C 1.539 1.565 0 N-CA-C 116.664 1.426 . . . . 0.0 116.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.0 m -162.43 162.96 27.88 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.558 3.143 . . . . 0.0 109.869 -172.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 90.2 m . . . . . 0 CA--C 1.537 0.471 0 C-N-CA 125.212 1.405 . . . . 0.0 109.771 167.353 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 t0 . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 122.547 1.165 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.453 ' N ' HG12 ' A' ' 24' ' ' VAL . 1.6 t-105 -56.67 -36.57 69.74 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.481 1.912 . . . . 0.0 112.357 168.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -45.08 89.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.034 1.334 . . . . 0.0 111.413 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.2 p -80.43 -30.94 37.64 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.854 1.262 . . . . 0.0 113.427 173.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -53.49 -44.14 68.79 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.318 1.447 . . . . 0.0 113.131 177.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -53.45 -61.58 2.21 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.147 0.979 . . . . 0.0 110.421 172.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -59.29 -20.06 51.29 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -72.66 -52.7 14.25 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.155 1.782 . . . . 0.0 113.856 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -133.14 7.88 3.99 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -175.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.4 mt -127.5 147.5 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 120.541 -1.349 . . . . 0.0 110.108 -172.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 12.5 t -143.34 154.99 44.31 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 174.066 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -91.18 0.52 57.51 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.194 1.798 . . . . 0.0 112.359 168.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.45 114.3 2.14 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.196 1.799 . . . . 0.0 111.192 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -67.93 103.39 1.47 Allowed 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.563 -1.336 . . . . 0.0 110.506 172.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -113.56 4.85 16.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.447 1.499 . . . . 0.0 113.046 177.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.6 t -79.74 142.55 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.434 1.093 . . . . 0.0 111.47 -176.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -128.71 9.66 5.95 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.032 1.733 . . . . 0.0 112.504 175.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 15.8 m 52.49 44.34 30.08 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.52 2.328 . . . . 0.0 113.043 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.7 -25.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.992 2.117 . . . . 0.0 113.245 -177.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -101.05 -5.05 26.28 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.751 1.22 . . . . 0.0 113.717 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.3 pt -61.41 -11.96 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.89 1.276 . . . . 0.0 114.005 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -57.37 -28.9 63.58 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.832 0.853 . . . . 0.0 112.923 167.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 t -83.82 1.26 43.92 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.01 1.724 . . . . 0.0 114.234 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.0 p -117.4 -177.02 3.13 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.611 1.565 . . . . 0.0 111.882 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -63.48 -17.85 63.16 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.14 -0.975 . . . . 0.0 113.539 171.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.77 11.71 25.99 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.204 1.802 . . . . 0.0 114.199 -170.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -63.3 -8.84 9.49 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.789 2.435 . . . . 0.0 115.313 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -62.28 -10.11 9.96 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.082 1.753 . . . . 0.0 114.759 -173.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 46.1 t 39.66 59.01 1.93 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.994 2.117 . . . . 0.0 113.234 -166.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.88 161.13 27.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.888 1.275 . . . . 0.0 111.743 162.437 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.88 -34.06 77.1 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.198 1.399 . . . . 0.0 114.381 -172.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.9 ptmt -160.02 157.05 28.02 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.7 1.6 . . . . 0.0 111.889 167.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -121.44 152.89 38.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.551 0.74 . . . . 0.0 109.42 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.5 m -112.36 98.13 7.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.017 1.327 . . . . 0.0 108.035 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -82.05 136.33 35.23 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.593 -0.692 . . . . 0.0 111.873 176.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.5 mt -109.12 109.7 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 125.942 1.697 . . . . 0.0 107.029 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.34 89.23 6.56 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.536 -0.727 . . . . 0.0 109.456 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 m -149.52 160.21 43.66 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.972 1.309 . . . . 0.0 112.687 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -70.16 163.42 61.86 Favored Pre-proline 0 N--CA 1.47 0.546 0 C-N-CA 124.326 1.05 . . . . 0.0 111.187 164.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.35 -23.55 27.97 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.312 2.008 . . . . 0.0 114.229 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.27 -57.7 23.92 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.088 -177.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.74 0.62 5.36 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.062 2.508 . . . . 0.0 114.855 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.27 -54.65 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.522 1.929 . . . . 0.0 109.748 176.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -46.01 76.29 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.129 -0.982 . . . . 0.0 112.745 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.44 -3.08 31.81 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -172.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.5 mt -53.19 -36.39 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 123.558 0.743 . . . . 0.0 110.403 168.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -107.96 159.0 16.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.084 0.954 . . . . 0.0 113.409 174.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.95 106.69 2.87 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.438 1.895 . . . . 0.0 109.779 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.53 5.08 90.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 124.301 0.953 . . . . 0.0 114.987 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.6 mt -75.85 116.11 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.646 1.179 . . . . 0.0 111.226 -176.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -110.82 -10.94 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 126.577 1.951 . . . . 0.0 111.008 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.14 3.76 5.22 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.447 2.299 . . . . 0.0 116.061 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 52.98 64.46 1.85 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.695 1.598 . . . . 0.0 112.717 -172.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -155.79 158.81 38.75 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.816 2.046 . . . . 0.0 110.968 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.483 HD22 HG23 ' A' ' 16' ' ' VAL . 6.9 t-20 -141.51 -167.56 2.45 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.715 -1.241 . . . . 0.0 111.469 163.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -124.51 145.7 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.331 1.452 . . . . 0.0 109.488 167.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -51.94 142.3 15.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.69 1.196 . . . . 0.0 111.944 168.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.22 172.77 2.28 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.7 t -122.66 -25.07 4.76 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.098 1.359 . . . . 0.0 113.931 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.3 m -80.52 170.93 15.69 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.76 1.224 . . . . 0.0 111.993 172.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -117.54 110.96 18.6 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.726 1.21 . . . . 0.0 111.348 -177.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -106.39 161.98 14.09 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.87 1.668 . . . . 0.0 110.603 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -71.57 108.01 4.73 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 121.745 -0.597 . . . . 0.0 110.297 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -99.89 119.21 37.85 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.594 1.558 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.1 t -122.43 97.33 5.41 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.038 1.335 . . . . 0.0 110.459 -171.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -93.52 163.03 13.73 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.512 0.725 . . . . 0.0 111.067 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.82 107.85 3.22 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.496 -0.753 . . . . 0.0 111.875 163.773 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -92.58 132.41 36.88 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.606 1.163 . . . . 0.0 111.215 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.0 t -56.72 148.07 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.509 1.523 . . . . 0.0 112.008 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.1 p -118.11 86.88 2.61 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.905 1.282 . . . . 0.0 111.684 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 32.2 p . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.833 1.653 . . . . 0.0 114.151 173.459 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 CA--C 1.539 0.749 0 CA-C-O 120.126 -0.031 . . . . 0.0 112.027 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 m -140.89 175.78 9.34 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.357 1.863 . . . . 0.0 110.417 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -97.42 130.07 44.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.522 1.129 . . . . 0.0 110.516 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -134.33 160.63 37.34 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.9 1.28 . . . . 0.0 112.205 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -109.57 153.14 24.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.536 1.934 . . . . 0.0 112.443 177.059 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.52 112.83 19.79 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.319 1.848 . . . . 0.0 111.727 -170.712 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -139.56 103.29 4.66 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.455 . . . . 0.0 112.275 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -124.32 149.82 46.15 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.316 1.046 . . . . 0.0 111.656 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.1 t -148.79 174.81 11.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.603 1.561 . . . . 0.0 111.9 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.1 m -140.45 102.87 4.43 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.032 0.933 . . . . 0.0 110.997 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -168.66 170.22 9.6 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.916 1.286 . . . . 0.0 113.45 -172.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.426 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -60.07 170.85 1.11 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.911 2.484 . . . . 0.0 113.617 168.551 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.22 147.65 35.19 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.369 1.868 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 t -106.1 141.91 36.68 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.063 0.945 . . . . 0.0 111.607 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.7 m -145.75 -179.4 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.175 1.79 . . . . 0.0 111.876 -175.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.3 m -127.17 118.55 24.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.144 0.978 . . . . 0.0 111.954 176.026 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.8 t -87.36 127.73 35.2 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.204 1.002 . . . . 0.0 111.794 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -135.58 114.72 12.3 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.057 1.343 . . . . 0.0 109.107 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.6 m120 57.25 57.04 4.72 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 112.535 -172.044 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 64.33 26.66 13.67 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.468 2.307 . . . . 0.0 114.719 170.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.41 135.08 6.56 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.961 1.304 . . . . 0.0 109.548 -177.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.56 107.85 2.57 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.714 2.943 . . . . 0.0 112.564 177.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.9 m -100.76 6.46 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.495 1.518 . . . . 0.0 112.236 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -148.53 146.62 28.4 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.797 1.635 . . . . 0.0 112.592 -175.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -103.0 131.7 49.79 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.732 1.213 . . . . 0.0 111.108 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -104.52 -52.96 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.146 0.978 . . . . 0.0 112.084 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.62 -172.58 44.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 119.098 0.863 . . . . 0.0 114.924 -173.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.8 t -123.69 124.01 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.724 1.61 . . . . 0.0 110.354 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 65.78 3.62 16.41 Favored Glycine 0 CA--C 1.54 1.594 0 N-CA-C 115.864 1.105 . . . . 0.0 115.864 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.5 m -169.88 163.75 9.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 128.62 2.768 . . . . 0.0 110.382 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m . . . . . 0 CA--C 1.542 0.668 0 C-N-CA 125.574 1.55 . . . . 0.0 110.532 172.987 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 p30 . . . . . 0 CA--C 1.54 0.574 0 CA-C-O 123.429 1.585 . . . . 0.0 113.092 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -57.18 -33.7 67.72 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.181 2.192 . . . . 0.0 113.787 174.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.96 -46.13 89.19 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.097 -1.002 . . . . 0.0 110.62 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.2 p -76.9 -26.53 54.24 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 173.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -52.81 -46.01 67.51 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.57 1.548 . . . . 0.0 112.46 175.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -56.96 -60.66 3.25 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.072 0.949 . . . . 0.0 110.791 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.99 -24.94 60.22 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.37 -54.58 22.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.649 1.58 . . . . 0.0 114.047 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -146.9 20.22 1.27 Allowed 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.3 mt -126.72 150.19 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.063 1.345 . . . . 0.0 109.701 173.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 t -141.68 151.9 43.42 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -84.03 -3.71 58.22 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.604 1.562 . . . . 0.0 112.909 170.124 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.0 t -162.26 118.26 1.97 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.255 1.822 . . . . 0.0 110.991 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.9 ttp-105 -69.0 100.31 1.2 Allowed 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.515 -1.365 . . . . 0.0 111.389 174.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -107.52 4.18 25.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.568 1.547 . . . . 0.0 113.171 173.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.5 t -75.45 138.72 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.327 1.451 . . . . 0.0 111.426 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -126.68 4.56 6.74 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.794 1.638 . . . . 0.0 113.155 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.6 m 54.16 35.78 23.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.98 2.112 . . . . 0.0 113.321 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -153.52 -27.38 0.14 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.742 2.417 . . . . 0.0 112.513 -172.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -115.06 3.88 14.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.146 1.778 . . . . 0.0 114.27 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.9 pt -63.57 -8.33 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.219 1.407 . . . . 0.0 113.617 174.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.9 ttt -54.1 -28.15 37.55 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.955 1.302 . . . . 0.0 112.752 162.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 t -92.98 -0.7 57.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.153 1.781 . . . . 0.0 114.215 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.8 p -114.76 -175.59 2.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.385 1.474 . . . . 0.0 111.4 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -64.15 -15.91 60.78 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 120.935 -1.103 . . . . 0.0 113.711 176.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -100.28 17.72 20.66 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.167 1.787 . . . . 0.0 114.24 -164.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -68.85 -7.64 36.31 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 128.984 2.914 . . . . 0.0 114.682 -173.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -63.28 2.26 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 128.179 2.592 . . . . 0.0 115.817 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.2 t 56.79 27.92 13.57 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.263 1.825 . . . . 0.0 114.117 -176.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 154.93 17.68 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.131 1.372 . . . . 0.0 112.207 177.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.7 -33.97 77.21 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.9 ptmm? -161.37 160.03 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.905 1.682 . . . . 0.0 112.676 167.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -131.03 125.37 33.09 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.377 1.071 . . . . 0.0 109.766 163.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -87.64 95.2 9.97 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.546 1.138 . . . . 0.0 109.964 171.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -82.5 127.83 33.7 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.878 -0.514 . . . . 0.0 111.455 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 61.8 mt -97.93 114.92 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 125.015 1.326 . . . . 0.0 107.845 172.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.26 87.45 7.14 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.46 0.704 . . . . 0.0 110.203 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.2 m -144.94 165.63 27.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.739 2.015 . . . . 0.0 112.549 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -74.22 164.28 62.35 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 124.339 1.056 . . . . 0.0 110.761 161.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.28 -23.98 17.2 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.509 2.139 . . . . 0.0 114.147 174.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.21 -55.59 44.73 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 124.419 1.088 . . . . 0.0 113.466 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.46 -1.51 9.18 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 123.107 2.538 . . . . 0.0 114.575 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.55 -54.24 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 126.249 1.819 . . . . 0.0 109.398 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -45.33 81.22 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.25 -0.906 . . . . 0.0 112.912 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.85 -3.63 36.28 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -171.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 52.8 mt -53.93 -35.34 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 123.609 0.764 . . . . 0.0 110.665 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 21.0 p -111.39 158.43 19.08 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.245 1.418 . . . . 0.0 113.118 173.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -155.56 112.99 3.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.978 1.711 . . . . 0.0 110.402 175.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.09 2.95 90.57 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.666 1.127 . . . . 0.0 114.97 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 50.6 mt -77.33 118.53 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.967 1.307 . . . . 0.0 111.063 -176.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.0 mt -111.15 -13.1 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.595 1.958 . . . . 0.0 111.046 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.2 1.96 6.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.389 2.276 . . . . 0.0 116.355 -168.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.66 68.47 0.82 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.594 1.558 . . . . 0.0 112.431 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -158.06 149.36 21.22 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.361 1.864 . . . . 0.0 110.516 -176.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -140.4 -168.1 2.48 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.643 -1.286 . . . . 0.0 111.364 164.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -126.36 149.38 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 125.636 1.575 . . . . 0.0 109.729 168.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.4 tp -53.47 142.39 22.28 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.75 1.22 . . . . 0.0 111.644 168.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.52 173.24 1.7 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 173.22 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.6 t -124.9 -23.38 4.29 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.755 1.222 . . . . 0.0 114.177 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.9 m -79.59 170.52 16.43 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.38 1.072 . . . . 0.0 111.498 169.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -124.73 104.94 8.93 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.139 0.976 . . . . 0.0 111.522 -173.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -101.65 163.11 12.43 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.058 2.143 . . . . 0.0 110.798 -171.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -75.6 105.89 6.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.597 -0.689 . . . . 0.0 110.669 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.81 119.47 35.34 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.834 1.253 . . . . 0.0 111.667 178.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.8 t -119.64 87.63 2.78 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 126.041 1.736 . . . . 0.0 110.001 -171.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.9 163.94 21.9 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.325 1.06 . . . . 0.0 111.318 168.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -154.99 124.45 6.41 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.67 1.588 . . . . 0.0 108.689 162.511 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -111.04 139.39 46.44 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.357 1.063 . . . . 0.0 109.909 -175.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 16.0 t -60.99 148.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.754 0.822 . . . . 0.0 111.89 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.2 t -140.48 86.05 2.04 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-O 122.694 1.235 . . . . 0.0 111.867 173.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.255 1.389 0 C-N-CA 125.745 1.618 . . . . 0.0 111.993 174.664 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo . . . . . 0 CA--C 1.538 0.691 0 N-CA-C 113.165 0.409 . . . . 0.0 113.165 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -141.11 167.49 22.06 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.701 2.4 . . . . 0.0 109.204 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.543 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.3 mmpt? -93.43 143.86 25.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.533 0.733 . . . . 0.0 111.174 172.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -138.25 161.64 36.36 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.557 1.543 . . . . 0.0 111.473 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -97.43 154.23 17.61 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 127.297 2.239 . . . . 0.0 110.863 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.2 tp -79.83 128.47 33.48 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.964 0.906 . . . . 0.0 111.062 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.9 tptt -148.66 97.08 2.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.519 1.528 . . . . 0.0 111.771 173.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -110.72 142.52 42.53 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.819 1.247 . . . . 0.0 110.931 175.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 38.7 m -153.42 172.69 16.71 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.971 1.708 . . . . 0.0 111.066 -176.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 m -145.44 101.57 3.6 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.969 -1.082 . . . . 0.0 110.885 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.28 175.12 8.51 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.034 1.333 . . . . 0.0 113.316 -176.27 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.12 170.7 3.44 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 128.215 2.606 . . . . 0.0 113.801 171.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -140.06 142.56 36.15 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.116 1.767 . . . . 0.0 111.802 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -101.62 141.82 33.91 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.855 0.862 . . . . 0.0 111.405 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.516 HG23 HD22 ' A' ' 104' ' ' ASN . 15.2 m -146.75 -178.95 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 126.32 1.848 . . . . 0.0 111.282 -175.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.2 m -125.68 117.92 24.53 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.436 1.094 . . . . 0.0 111.194 174.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -84.4 134.57 34.47 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.564 0.697 . . . . 0.0 111.336 172.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.75 114.62 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.421 1.489 . . . . 0.0 108.403 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.7 m120 57.98 55.78 5.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.668 1.187 . . . . 0.0 112.504 -171.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.9 24.43 11.23 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 127.655 2.382 . . . . 0.0 115.189 169.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.16 133.41 6.14 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 124.914 1.285 . . . . 0.0 109.421 -176.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.04 103.39 1.73 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.71 2.94 . . . . 0.0 112.354 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 m -98.41 10.08 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.178 1.391 . . . . 0.0 112.288 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -150.62 143.66 24.75 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.851 1.659 . . . . 0.0 112.295 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -98.2 137.12 37.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.217 1.007 . . . . 0.0 111.29 174.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -110.86 -53.77 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.97 0.908 . . . . 0.0 111.754 178.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.38 -171.12 42.91 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-N 118.782 0.719 . . . . 0.0 114.227 -174.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.14 129.45 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 0.0 109.799 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.16 0.21 7.19 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -168.58 164.27 12.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.577 2.351 . . . . 0.0 110.645 -174.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.5 m . . . . . 0 CA--C 1.543 0.692 0 C-N-CA 125.994 1.718 . . . . 0.0 111.419 173.968 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 p30 . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 123.107 1.432 . . . . 0.0 112.94 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -59.44 -34.05 72.03 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.436 1.895 . . . . 0.0 113.715 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.09 -44.73 96.04 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.982 -1.073 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 p -76.18 -28.02 57.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.05 1.34 . . . . 0.0 113.965 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -52.44 -45.19 65.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.65 1.568 . . . . 0.0 112.749 176.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.58 -62.81 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.447 1.099 . . . . 0.0 110.629 173.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -60.55 -19.78 58.37 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.67 -51.15 44.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.176 1.79 . . . . 0.0 113.769 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -151.24 23.4 0.73 Allowed 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -174.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -127.99 148.9 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 125.493 1.517 . . . . 0.0 109.367 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -146.74 156.95 43.55 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -92.74 2.7 56.6 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.227 1.811 . . . . 0.0 112.403 169.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.03 114.06 2.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.216 1.806 . . . . 0.0 111.089 172.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.6 ttp-105 -66.58 106.33 1.76 Allowed 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.675 -1.266 . . . . 0.0 110.643 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -116.05 4.16 13.68 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.353 1.461 . . . . 0.0 113.346 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.3 p -75.91 145.69 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.392 1.077 . . . . 0.0 112.978 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -130.88 6.85 4.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.24 1.816 . . . . 0.0 112.943 173.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 m 50.78 47.7 24.08 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 127.589 2.355 . . . . 0.0 113.53 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.12 -28.23 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.651 2.38 . . . . 0.0 112.323 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -103.65 0.44 30.7 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.183 1.393 . . . . 0.0 113.563 179.033 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.7 pt -62.81 -11.53 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.095 1.358 . . . . 0.0 113.706 177.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -54.67 -31.3 57.5 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.238 1.015 . . . . 0.0 112.899 165.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.1 m -82.39 1.71 35.95 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.219 1.408 . . . . 0.0 114.527 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.7 p -118.0 -176.12 2.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.895 1.678 . . . . 0.0 111.715 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -64.86 -19.12 65.72 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.21 13.08 12.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.364 1.866 . . . . 0.0 114.208 -172.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -66.31 -9.74 35.95 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.032 2.133 . . . . 0.0 114.82 -172.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -7.75 3.78 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.625 2.37 . . . . 0.0 115.554 -173.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.0 t 39.11 58.69 1.8 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 126.793 2.037 . . . . 0.0 113.635 -168.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.403 ' HG3' ' H ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER -68.91 160.98 29.72 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.136 1.374 . . . . 0.0 112.025 162.445 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.84 -31.27 71.77 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -170.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -160.12 156.23 26.42 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.402 1.481 . . . . 0.0 111.959 169.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -132.1 112.68 12.53 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.115 0.966 . . . . 0.0 111.032 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.8 m -83.43 96.71 8.64 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.442 0.697 . . . . 0.0 110.439 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -80.64 132.87 35.65 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 122.835 0.454 . . . . 0.0 111.233 173.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 78.1 mt -104.95 113.54 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.196 1.398 . . . . 0.0 107.661 171.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -85.6 86.43 7.37 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.313 0.578 . . . . 0.0 109.614 167.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -150.39 167.42 27.14 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.95 1.3 . . . . 0.0 112.518 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -79.85 160.68 68.53 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 126.059 1.744 . . . . 0.0 110.536 175.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -70.54 -22.84 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.076 1.851 . . . . 0.0 114.593 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.32 -57.14 21.7 Favored Pre-proline 0 N--CA 1.473 0.721 0 C-N-CA 124.214 1.006 . . . . 0.0 112.977 -178.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.04 -0.27 5.34 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.212 2.608 . . . . 0.0 114.897 178.45 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.6 t -101.33 -54.9 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.584 1.953 . . . . 0.0 109.736 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -45.78 78.55 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.288 -0.883 . . . . 0.0 112.924 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.53 -2.96 31.46 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.4 mt -53.41 -35.87 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.618 0.767 . . . . 0.0 110.486 169.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.1 p -109.56 158.93 17.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.415 1.086 . . . . 0.0 113.222 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -155.57 103.27 2.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.114 1.766 . . . . 0.0 109.899 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.93 4.57 84.51 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.389 0.995 . . . . 0.0 114.807 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.2 mt -74.93 114.76 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.599 1.2 . . . . 0.0 111.113 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.93 -15.13 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 126.717 2.007 . . . . 0.0 110.68 171.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.54 23.92 0.21 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.666 2.787 . . . . 0.0 115.45 -171.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.2 p 41.28 64.63 0.97 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.334 1.854 . . . . 0.0 114.069 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.6 158.7 40.13 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.709 1.603 . . . . 0.0 111.215 -177.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.516 HD22 HG23 ' A' ' 16' ' ' VAL . 5.7 t-20 -142.34 -170.63 3.22 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.738 -1.226 . . . . 0.0 111.796 160.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -124.09 139.58 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.541 1.537 . . . . 0.0 108.705 171.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.85 140.17 12.22 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.551 1.14 . . . . 0.0 111.906 170.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.4 172.28 1.59 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.1 t -119.55 -29.65 5.04 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.969 1.308 . . . . 0.0 113.366 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.7 m -77.14 169.58 18.08 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.305 1.442 . . . . 0.0 112.171 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -117.83 107.39 14.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.442 1.097 . . . . 0.0 111.22 -177.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -100.55 161.81 13.35 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.729 1.612 . . . . 0.0 110.595 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -72.1 106.38 4.32 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.285 0.564 . . . . 0.0 110.294 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -97.63 122.19 40.42 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.498 1.519 . . . . 0.0 110.889 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 37.8 t -126.14 93.63 3.87 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.512 1.525 . . . . 0.0 109.312 -173.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -93.69 163.09 13.68 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.286 1.041 . . . . 0.0 111.057 172.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -148.51 134.8 19.44 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.54 1.536 . . . . 0.0 108.429 164.153 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.3 m-80 -118.27 127.94 54.2 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.512 1.125 . . . . 0.0 110.391 -175.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.27 144.85 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.657 0.783 . . . . 0.0 111.874 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -135.31 103.51 5.53 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.919 1.287 . . . . 0.0 111.197 173.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.255 1.351 0 C-N-CA 126.238 1.815 . . . . 0.0 112.394 179.662 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo . . . . . 0 CA--C 1.537 0.643 0 CA-C-O 120.694 0.206 . . . . 0.0 112.239 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.79 168.82 18.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.466 1.906 . . . . 0.0 110.207 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -88.79 127.96 35.63 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.653 1.181 . . . . 0.0 111.161 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -138.79 155.32 48.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.422 1.089 . . . . 0.0 113.336 179.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -93.77 155.41 17.24 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.254 2.222 . . . . 0.0 111.725 179.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.39 114.5 21.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.678 1.591 . . . . 0.0 111.675 176.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -139.34 114.87 9.89 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.582 1.553 . . . . 0.0 111.338 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -132.74 147.39 52.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.742 1.617 . . . . 0.0 111.179 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.8 m -156.86 171.86 19.67 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.535 1.934 . . . . 0.0 111.683 -177.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -142.38 105.02 4.51 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.548 -0.72 . . . . 0.0 111.103 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -170.68 173.98 5.16 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.051 1.34 . . . . 0.0 113.397 -170.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.9 173.43 0.77 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.596 2.358 . . . . 0.0 114.273 168.101 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.9 p90 -144.14 145.34 32.05 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.022 2.129 . . . . 0.0 111.441 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 t -107.17 143.94 34.62 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.915 0.864 . . . . 0.0 112.441 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.533 HG23 HD22 ' A' ' 104' ' ' ASN . 16.0 m -149.22 -179.39 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 126.621 1.968 . . . . 0.0 111.62 -171.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.7 m -126.36 120.53 30.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.148 0.979 . . . . 0.0 111.336 174.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.31 132.69 34.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.961 0.905 . . . . 0.0 111.277 174.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -136.85 121.72 18.76 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.229 1.412 . . . . 0.0 108.53 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.6 m120 55.43 53.76 9.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.614 1.165 . . . . 0.0 112.46 -171.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 64.91 26.45 12.82 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.379 2.271 . . . . 0.0 115.04 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -156.54 132.78 6.0 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.806 1.243 . . . . 0.0 109.587 -176.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -76.06 105.37 2.07 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.735 2.957 . . . . 0.0 112.283 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.42 HG12 ' N ' ' A' ' 51' ' ' TRP . 7.3 m -104.61 15.83 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.688 1.595 . . . . 0.0 112.397 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.417 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 16.5 t-80 -154.96 145.74 22.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.696 1.135 . . . . 0.0 112.114 -176.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -102.15 137.53 40.29 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.534 1.134 . . . . 0.0 111.356 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 43.9 t -111.87 -52.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.926 0.89 . . . . 0.0 112.539 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.23 -172.43 43.45 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-N 119.194 0.906 . . . . 0.0 115.198 -171.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t -128.19 126.82 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.976 1.71 . . . . 0.0 110.786 -170.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.51 -13.12 5.2 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.746 1.165 . . . . 0.0 115.753 176.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.6 m -163.35 169.61 18.78 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 130.926 3.691 . . . . 0.0 108.469 -164.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 CA--C 1.54 0.569 0 C-N-CA 124.045 0.938 . . . . 0.0 111.383 179.221 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 122.677 1.227 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.42 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.7 t-105 -56.65 -37.08 70.27 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.477 2.311 . . . . 0.0 112.698 170.544 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -42.63 91.24 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 0.0 111.357 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.3 p -85.4 -27.14 25.99 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.119 1.368 . . . . 0.0 113.941 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -51.48 -41.68 61.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.283 1.433 . . . . 0.0 112.682 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -57.56 -64.34 0.93 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.026 0.931 . . . . 0.0 110.614 172.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -59.87 -21.0 60.41 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -65.77 -51.44 59.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.307 1.843 . . . . 0.0 112.572 175.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -150.46 22.21 0.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -174.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -128.91 144.67 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.196 -1.565 . . . . 0.0 109.517 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -143.06 153.46 42.96 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -84.38 -0.45 52.72 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.733 1.613 . . . . 0.0 112.714 169.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.7 t -164.09 112.18 1.15 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.259 1.824 . . . . 0.0 111.405 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.6 ttp85 -67.99 104.53 1.76 Allowed 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.429 -1.42 . . . . 0.0 110.583 172.173 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -116.84 3.31 12.91 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.457 1.503 . . . . 0.0 113.193 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.444 HG22 ' H ' ' A' ' 67' ' ' CYS . 10.5 p -73.8 147.4 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.042 1.337 . . . . 0.0 112.573 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -134.6 9.18 3.64 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.92 1.688 . . . . 0.0 112.531 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.444 ' H ' HG22 ' A' ' 65' ' ' VAL . 35.2 m 51.47 38.68 22.7 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.444 2.298 . . . . 0.0 113.193 -175.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -145.33 -36.17 0.3 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 128.386 2.674 . . . . 0.0 112.655 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -100.08 -4.33 30.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.666 1.586 . . . . 0.0 113.633 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -60.27 -14.59 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.546 1.138 . . . . 0.0 113.637 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.8 ttt -53.91 -26.63 26.1 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.938 1.695 . . . . 0.0 113.568 168.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.0 t -103.49 1.98 33.05 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.95 1.7 . . . . 0.0 113.849 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -103.31 -174.2 2.49 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 125.494 1.518 . . . . 0.0 111.552 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -63.25 -20.62 65.61 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.129 -0.982 . . . . 0.0 113.582 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.38 12.32 27.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.77 1.628 . . . . 0.0 114.059 -166.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -65.2 -5.11 6.09 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.516 2.726 . . . . 0.0 114.914 -176.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.5 t60 -61.27 -4.8 1.31 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.976 2.11 . . . . 0.0 115.069 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.4 t 56.55 33.76 23.21 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.327 1.851 . . . . 0.0 113.77 -177.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 160.08 14.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.377 1.471 . . . . 0.0 112.351 176.089 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -67.04 -36.45 82.1 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.562 1.145 . . . . 0.0 113.754 -172.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -159.66 159.62 33.24 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.049 1.34 . . . . 0.0 111.841 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -140.52 127.98 21.35 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.383 0.673 . . . . 0.0 110.433 167.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.0 m -92.41 91.95 7.88 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.685 176.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -75.63 125.29 28.74 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.657 0.783 . . . . 0.0 111.043 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 91.5 mt -103.41 115.8 46.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 125.39 1.476 . . . . 0.0 107.661 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -89.49 86.17 6.7 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.67 0.748 . . . . 0.0 109.749 169.079 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.0 p -146.46 166.59 25.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.092 1.757 . . . . 0.0 111.959 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 29.1 mmm-85 -78.71 161.09 70.52 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 125.092 1.357 . . . . 0.0 110.422 172.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.93 -21.23 32.99 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 122.102 1.868 . . . . 0.0 114.436 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.12 -57.0 23.05 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-O 117.983 -1.008 . . . . 0.0 112.575 -178.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.22 -0.25 5.44 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.25 2.633 . . . . 0.0 115.168 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -100.96 -55.24 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 126.07 1.748 . . . . 0.0 109.833 174.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.09 -44.4 80.11 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.159 -0.963 . . . . 0.0 112.989 -179.204 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.47 -2.96 31.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -173.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.36 -35.77 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.668 0.787 . . . . 0.0 110.483 169.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.3 p -109.67 158.54 17.97 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.414 1.086 . . . . 0.0 113.308 174.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -153.26 107.72 3.12 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.318 1.847 . . . . 0.0 109.833 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.6 5.23 90.06 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.337 0.97 . . . . 0.0 114.786 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.4 mt -75.73 114.74 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.564 1.146 . . . . 0.0 111.028 -177.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.1 mt -109.58 -12.62 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 126.685 1.994 . . . . 0.0 110.861 172.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.99 5.45 3.31 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.665 2.386 . . . . 0.0 116.143 -171.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.4 t 51.39 65.73 1.4 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.58 1.552 . . . . 0.0 112.904 -172.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -154.44 157.93 39.2 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.214 1.806 . . . . 0.0 111.076 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.533 HD22 HG23 ' A' ' 16' ' ' VAL . 6.2 t-20 -142.02 -169.98 3.05 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.783 -1.198 . . . . 0.0 111.86 163.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.5 t -124.36 141.87 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.681 1.592 . . . . 0.0 108.7 170.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -51.02 142.31 12.32 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.811 1.245 . . . . 0.0 111.742 169.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.54 172.24 2.17 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.0 t -120.26 -26.28 5.5 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.199 1.399 . . . . 0.0 113.519 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.0 m -81.06 171.01 15.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.492 1.517 . . . . 0.0 112.006 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -116.54 110.56 18.73 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.504 1.122 . . . . 0.0 111.34 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -106.38 158.31 16.98 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.818 1.647 . . . . 0.0 109.893 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.45 110.75 5.53 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.634 -0.666 . . . . 0.0 110.719 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -101.03 125.51 47.65 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.635 1.574 . . . . 0.0 111.766 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 39.0 t -130.8 91.7 3.11 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.386 1.475 . . . . 0.0 110.796 -172.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -85.5 163.32 18.5 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.959 0.885 . . . . 0.0 111.87 170.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -146.05 140.59 26.9 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 158.225 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -128.82 129.35 45.49 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.983 0.913 . . . . 0.0 109.907 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.83 146.63 8.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.87 0.868 . . . . 0.0 112.687 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.02 77.77 1.68 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 122.926 1.346 . . . . 0.0 111.863 174.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 75.7 m . . . . . 0 C--O 1.252 1.221 0 C-N-CA 127.44 2.296 . . . . 0.0 112.697 177.708 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo . . . . . 0 CA--C 1.545 1.064 0 N-CA-C 113.642 0.593 . . . . 0.0 113.642 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 86.9 m -128.53 174.84 9.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 127.224 2.21 . . . . 0.0 109.482 169.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -105.48 145.19 31.21 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.173 1.389 . . . . 0.0 108.625 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.78 158.51 43.85 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.942 1.297 . . . . 0.0 110.923 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -100.11 159.42 15.12 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 113.22 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.57 105.7 17.03 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.654 1.582 . . . . 0.0 111.362 -169.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -131.96 112.47 12.43 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.638 1.575 . . . . 0.0 111.051 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -131.44 141.91 49.91 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.916 1.687 . . . . 0.0 111.016 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.4 m -146.74 168.06 22.31 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.807 1.643 . . . . 0.0 111.348 -175.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -141.15 103.65 4.48 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.572 -0.705 . . . . 0.0 111.296 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -171.0 173.52 5.06 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.99 1.316 . . . . 0.0 113.068 -169.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.25 171.77 0.96 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.489 2.316 . . . . 0.0 113.841 167.239 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -142.64 147.7 36.21 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.783 2.033 . . . . 0.0 111.197 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.3 t -107.58 141.34 39.19 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.896 0.879 . . . . 0.0 111.341 176.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.488 HG23 HD22 ' A' ' 104' ' ' ASN . 15.8 m -146.86 -178.92 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 126.35 1.86 . . . . 0.0 111.25 -175.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.7 m -126.77 119.24 26.39 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 121.257 -0.902 . . . . 0.0 111.45 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.2 132.4 34.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.96 0.904 . . . . 0.0 111.668 175.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -140.13 115.67 10.06 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.038 1.335 . . . . 0.0 108.796 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.7 m120 58.68 56.37 4.24 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.273 1.429 . . . . 0.0 112.397 -169.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 64.54 24.3 13.04 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.737 2.415 . . . . 0.0 115.06 169.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.86 132.71 5.43 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.827 1.251 . . . . 0.0 109.444 -173.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -76.28 106.45 2.26 Favored 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 123.794 2.996 . . . . 0.0 112.189 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.44 HG12 ' N ' ' A' ' 51' ' ' TRP . 5.9 m -101.38 14.33 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.329 1.452 . . . . 0.0 111.85 -178.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 20.8 t-80 -158.95 141.8 14.39 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.037 1.29 . . . . 0.0 112.651 -167.322 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -92.67 146.95 23.27 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.613 0.765 . . . . 0.0 112.096 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.9 t -120.1 -55.7 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 124.146 0.978 . . . . 0.0 112.436 172.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.39 -173.36 42.83 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 119.297 0.953 . . . . 0.0 115.388 -170.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -127.0 122.99 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.97 1.708 . . . . 0.0 110.235 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.54 -0.05 7.44 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 115.959 1.143 . . . . 0.0 115.959 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.1 m -170.29 165.66 8.86 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 129.28 3.032 . . . . 0.0 110.289 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.9 m . . . . . 0 CA--C 1.542 0.673 0 C-N-CA 125.742 1.617 . . . . 0.0 110.839 174.731 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 t0 . . . . . 0 CA--C 1.543 0.695 0 CA-C-O 122.528 1.156 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.44 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.5 t-105 -53.74 -36.56 62.44 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 127.079 2.152 . . . . 0.0 112.274 168.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.32 -45.44 93.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.809 0.844 . . . . 0.0 111.015 177.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.9 p -72.01 -35.61 69.47 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -54.14 -44.11 71.13 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.463 1.505 . . . . 0.0 113.065 -177.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.14 -62.04 1.91 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.367 1.067 . . . . 0.0 110.725 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.403 ' H ' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -61.65 -20.29 63.24 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -179.215 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -68.62 -54.78 14.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 113.437 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -133.17 6.7 3.9 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -172.361 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.12 147.49 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 O-C-N 120.387 -1.446 . . . . 0.0 110.107 -173.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -142.49 153.26 43.49 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -81.55 -5.54 58.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.857 1.663 . . . . 0.0 112.882 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.1 t -165.14 121.22 1.41 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.633 1.973 . . . . 0.0 110.569 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.0 ttp-105 -66.44 104.52 1.26 Allowed 'General case' 0 N--CA 1.473 0.711 0 O-C-N 120.488 -1.383 . . . . 0.0 110.8 174.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -113.97 2.79 15.13 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.219 1.408 . . . . 0.0 113.455 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.454 HG22 ' H ' ' A' ' 67' ' ' CYS . 9.7 p -74.7 146.03 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.115 0.966 . . . . 0.0 112.235 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -130.4 7.36 4.93 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.891 1.676 . . . . 0.0 112.742 171.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.454 ' H ' HG22 ' A' ' 65' ' ' VAL . 18.6 m 52.26 42.99 31.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.602 2.361 . . . . 0.0 113.023 -177.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -155.77 -25.61 0.11 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.405 2.282 . . . . 0.0 113.349 -178.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -106.32 -4.21 20.29 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.058 1.343 . . . . 0.0 113.94 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 pt -60.33 -12.29 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.006 1.322 . . . . 0.0 113.885 -179.024 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -24.23 28.36 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 167.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 69.8 m -91.29 -5.37 54.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.363 1.465 . . . . 0.0 114.356 174.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.4 p -103.43 -176.7 3.16 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.497 1.519 . . . . 0.0 111.927 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -64.98 -19.49 66.01 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.173 -0.954 . . . . 0.0 113.465 171.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -93.64 20.12 7.82 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.008 2.123 . . . . 0.0 113.471 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -63.94 -9.26 14.52 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.022 2.129 . . . . 0.0 114.61 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -63.55 -2.33 1.59 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.853 2.461 . . . . 0.0 115.342 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 57.82 21.03 7.08 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.149 1.78 . . . . 0.0 114.755 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.67 157.81 11.21 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.79 2.036 . . . . 0.0 114.485 -173.271 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.02 -39.46 78.4 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.081 1.752 . . . . 0.0 114.694 -168.226 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -159.4 157.49 30.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.161 1.384 . . . . 0.0 112.525 167.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -135.1 128.67 32.63 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.339 1.056 . . . . 0.0 110.532 167.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.1 m -88.77 99.12 12.11 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.989 0.916 . . . . 0.0 109.659 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -82.5 135.05 35.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.321 -0.862 . . . . 0.0 112.337 174.176 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 66.4 mt -107.73 111.17 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 125.702 1.601 . . . . 0.0 107.676 174.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.98 86.67 7.35 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.56 -0.713 . . . . 0.0 109.845 169.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 t -152.32 175.0 13.13 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.244 1.018 . . . . 0.0 113.338 168.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -74.61 162.68 72.62 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 128.03 2.532 . . . . 0.0 110.678 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.43 -24.94 18.7 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 122.267 1.978 . . . . 0.0 114.02 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.82 -55.53 37.36 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.397 1.079 . . . . 0.0 113.07 -176.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.26 -1.26 7.75 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.829 2.353 . . . . 0.0 114.724 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.7 t -99.89 -54.61 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.152 1.781 . . . . 0.0 109.6 174.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.403 ' HE3' ' NE1' ' A' ' 51' ' ' TRP . 0.0 OUTLIER -66.54 -46.06 77.39 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.217 -0.927 . . . . 0.0 112.983 -179.184 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.56 -2.99 31.69 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -171.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.0 mt -53.25 -35.89 24.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.793 0.837 . . . . 0.0 110.599 169.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -110.34 158.97 17.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 0.0 113.204 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -156.41 104.34 2.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.18 1.792 . . . . 0.0 109.932 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.92 3.15 85.81 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 124.465 1.031 . . . . 0.0 114.949 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.0 mt -74.82 115.48 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.542 1.171 . . . . 0.0 111.238 -177.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -108.81 -13.1 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 126.383 1.873 . . . . 0.0 110.962 171.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.06 4.1 3.82 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.517 2.327 . . . . 0.0 116.262 -170.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.4 t 53.14 64.4 1.87 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.619 1.568 . . . . 0.0 112.804 -173.106 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -155.49 158.23 38.19 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.399 1.88 . . . . 0.0 111.091 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.488 HD22 HG23 ' A' ' 16' ' ' VAL . 6.9 t-20 -141.52 -167.97 2.54 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.659 -1.275 . . . . 0.0 111.721 164.789 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.59 146.18 31.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 125.579 1.552 . . . . 0.0 109.603 167.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.6 tp -51.41 142.72 13.06 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.891 1.276 . . . . 0.0 112.002 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.73 173.09 1.86 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.283 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -122.99 -23.89 4.88 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.092 1.357 . . . . 0.0 113.943 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.8 m -81.42 171.07 15.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.778 1.231 . . . . 0.0 111.947 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.76 106.65 13.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.778 1.231 . . . . 0.0 111.676 -176.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -101.28 162.73 12.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.036 1.735 . . . . 0.0 110.877 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -73.3 105.64 4.79 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.694 -0.629 . . . . 0.0 110.382 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.96 122.63 38.98 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.068 1.347 . . . . 0.0 111.466 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 32.8 t -124.72 91.42 3.44 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.997 1.319 . . . . 0.0 110.726 -173.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -83.98 161.8 20.64 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.601 0.76 . . . . 0.0 111.693 171.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.76 109.78 3.7 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.115 0.966 . . . . 0.0 110.669 163.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.53 130.91 43.6 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.515 1.126 . . . . 0.0 110.828 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.4 t -57.74 150.38 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.321 1.448 . . . . 0.0 112.137 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 68.1 p -123.97 101.19 7.11 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.622 1.569 . . . . 0.0 111.453 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 55.2 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 128.078 2.551 . . . . 0.0 114.512 178.719 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 CA--C 1.538 0.701 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.28 176.82 9.26 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.59 2.356 . . . . 0.0 109.6 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.486 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 11.4 mmpt? -115.28 131.98 56.76 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.982 1.313 . . . . 0.0 110.702 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -136.2 160.67 37.99 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.531 . . . . 0.0 112.151 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -92.2 155.83 17.73 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.631 1.972 . . . . 0.0 112.145 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 107.71 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.652 1.581 . . . . 0.0 111.395 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.1 tptt -136.56 114.73 11.57 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.686 1.595 . . . . 0.0 111.069 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -133.34 132.09 40.88 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.989 1.716 . . . . 0.0 110.609 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 66.1 m -144.87 178.48 7.98 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.523 1.929 . . . . 0.0 111.595 -172.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 m -147.01 102.11 3.48 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.588 -1.32 . . . . 0.0 110.871 178.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -163.35 173.7 12.91 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.47 1.108 . . . . 0.0 113.652 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 168.31 5.19 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 128.133 2.573 . . . . 0.0 113.433 172.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.3 p90 -139.77 140.37 36.68 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.707 1.603 . . . . 0.0 111.868 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.6 t -98.72 143.11 29.44 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.204 1.002 . . . . 0.0 111.487 174.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.486 HG23 HD22 ' A' ' 104' ' ' ASN . 16.5 m -147.22 -178.6 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 126.565 1.946 . . . . 0.0 111.193 -176.466 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.444 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 3.2 m -127.35 119.53 26.45 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.333 -0.854 . . . . 0.0 111.307 174.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.67 133.59 33.68 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.552 0.741 . . . . 0.0 111.248 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -138.73 114.33 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.337 1.455 . . . . 0.0 108.472 175.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.8 m120 58.27 56.44 4.48 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.0 1.32 . . . . 0.0 112.489 -170.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.01 25.02 12.65 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.492 2.317 . . . . 0.0 115.091 169.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.39 132.57 5.55 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.921 1.288 . . . . 0.0 109.553 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -76.26 105.52 2.09 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.812 3.008 . . . . 0.0 112.147 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.405 HG12 ' N ' ' A' ' 51' ' ' TRP . 8.5 m -101.02 15.14 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.106 1.363 . . . . 0.0 111.956 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.444 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 24.7 t-80 -157.47 139.82 14.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.877 1.217 . . . . 0.0 112.741 -169.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -96.75 140.58 31.12 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.721 0.808 . . . . 0.0 111.306 173.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 92.1 t -109.8 -58.06 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.073 0.949 . . . . 0.0 111.598 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.08 -173.45 45.6 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 118.648 0.658 . . . . 0.0 113.191 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.4 p -115.46 138.76 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.295 1.038 . . . . 0.0 110.981 178.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 60.46 4.69 4.1 Favored Glycine 0 CA--C 1.544 1.895 0 N-CA-C 116.992 1.557 . . . . 0.0 116.992 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -167.41 158.93 11.99 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.213 2.205 . . . . 0.0 110.749 -174.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.2 m . . . . . 0 CA--C 1.54 0.566 0 C-N-CA 126.004 1.721 . . . . 0.0 111.042 172.983 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t0 . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 121.884 0.85 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.405 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -55.31 -37.74 67.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.51 1.924 . . . . 0.0 112.139 170.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -37.6 78.17 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.775 1.23 . . . . 0.0 112.187 -179.147 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -92.81 -25.2 18.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.778 1.231 . . . . 0.0 113.587 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -52.65 -41.62 63.94 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.531 1.532 . . . . 0.0 113.15 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -56.83 -61.54 2.36 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.081 0.953 . . . . 0.0 110.588 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -56.5 -26.35 54.15 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -65.73 -48.42 71.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.284 1.434 . . . . 0.0 112.863 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -153.16 24.51 0.55 Allowed 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.277 1.584 . . . . 0.0 115.277 -176.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -129.66 145.1 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.527 -1.358 . . . . 0.0 109.538 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.3 t -145.21 158.67 43.77 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 178.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -90.72 3.44 54.28 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.487 1.915 . . . . 0.0 112.679 167.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.1 t -164.44 113.84 1.17 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.506 1.922 . . . . 0.0 111.3 174.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -66.57 104.25 1.24 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.606 -1.309 . . . . 0.0 110.628 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -115.58 4.3 14.14 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.537 1.535 . . . . 0.0 113.374 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.0 p -72.68 145.21 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.891 1.276 . . . . 0.0 112.721 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -132.47 5.66 4.06 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.17 1.788 . . . . 0.0 113.106 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 34.6 m 52.64 39.72 28.8 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.521 2.328 . . . . 0.0 114.378 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -153.87 -27.35 0.13 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 128.34 2.656 . . . . 0.0 112.213 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -109.1 2.36 21.08 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.709 1.603 . . . . 0.0 113.695 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -61.58 -12.66 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.171 1.388 . . . . 0.0 113.6 177.061 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -52.44 -34.15 47.46 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.641 1.176 . . . . 0.0 112.879 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.3 t -80.7 2.3 26.53 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.119 1.368 . . . . 0.0 114.218 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.1 p -121.19 -177.45 3.52 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.967 1.707 . . . . 0.0 111.845 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -62.51 -19.66 63.83 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 172.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.73 7.31 24.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.315 1.846 . . . . 0.0 114.558 -171.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -64.07 -5.57 4.94 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.968 2.107 . . . . 0.0 114.904 -176.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -61.92 -5.45 2.12 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.435 1.894 . . . . 0.0 114.681 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.6 t 53.0 35.61 19.88 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.301 2.241 . . . . 0.0 114.847 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 160.57 17.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.868 1.667 . . . . 0.0 113.063 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -68.34 -27.32 66.16 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.059 1.744 . . . . 0.0 115.253 -171.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -162.72 159.04 23.8 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.425 1.49 . . . . 0.0 112.404 166.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -134.19 141.78 47.18 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.3 1.04 . . . . 0.0 110.557 168.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.2 m -108.2 94.12 4.9 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.978 1.311 . . . . 0.0 109.532 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -78.98 136.09 37.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.78 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 88.8 mt -113.26 115.65 50.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 126.077 1.751 . . . . 0.0 108.271 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -85.15 86.41 7.38 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.775 -0.578 . . . . 0.0 110.327 168.706 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.4 m -142.09 155.04 45.35 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.193 1.397 . . . . 0.0 112.748 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.1 mtp180 -70.36 161.78 74.16 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.239 1.016 . . . . 0.0 110.174 162.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.79 -22.33 37.02 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.764 1.643 . . . . 0.0 114.632 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.26 -58.19 20.6 Favored Pre-proline 0 N--CA 1.474 0.763 0 CA-C-N 119.691 1.132 . . . . 0.0 113.185 -177.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.21 0.5 5.14 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.339 2.692 . . . . 0.0 114.858 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.9 t -102.97 -55.07 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 126.515 1.926 . . . . 0.0 109.712 176.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.0 -44.86 79.27 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.27 -0.894 . . . . 0.0 112.819 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.7 -3.08 32.73 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -173.018 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.9 mt -53.45 -35.81 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 123.52 0.728 . . . . 0.0 110.473 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.2 p -109.29 158.94 17.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.461 1.104 . . . . 0.0 113.236 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -155.43 106.04 2.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.169 1.788 . . . . 0.0 109.961 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 4.09 87.57 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.483 1.04 . . . . 0.0 114.886 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.1 mt -75.73 115.15 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 118.5 1.15 . . . . 0.0 111.27 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.7 -11.89 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.628 1.971 . . . . 0.0 110.847 172.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 9.01 1.53 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.859 2.463 . . . . 0.0 116.1 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 83.0 p 49.27 63.76 2.02 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.757 1.623 . . . . 0.0 113.455 -172.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -154.61 155.71 35.2 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 126.715 2.006 . . . . 0.0 111.116 -176.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.486 HD22 HG23 ' A' ' 16' ' ' VAL . 6.7 t-20 -141.9 -167.23 2.4 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.722 -1.236 . . . . 0.0 111.475 162.22 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 19.2 t -127.41 143.59 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.762 1.625 . . . . 0.0 108.711 170.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -50.05 141.25 11.2 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.567 1.147 . . . . 0.0 111.968 168.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 173.2 1.28 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 172.453 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -119.88 -32.74 4.16 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.75 1.22 . . . . 0.0 113.406 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.8 m -74.84 172.11 12.79 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.506 1.522 . . . . 0.0 112.168 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -121.21 116.63 25.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.583 1.153 . . . . 0.0 110.923 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -113.54 157.25 22.28 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.913 1.685 . . . . 0.0 109.805 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.63 112.45 4.17 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.398 0.545 . . . . 0.0 110.106 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.96 123.07 48.83 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.372 1.469 . . . . 0.0 110.843 -170.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 28.3 t -129.46 97.42 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.63 1.172 . . . . 0.0 109.924 -167.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -87.73 159.75 18.36 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.742 0.817 . . . . 0.0 110.779 171.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -145.08 128.09 16.52 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.963 0.905 . . . . 0.0 108.769 158.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -116.39 127.66 54.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.014 1.326 . . . . 0.0 109.849 -175.374 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 36.7 t -59.14 145.22 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-O 121.263 0.554 . . . . 0.0 112.111 -176.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.7 t -132.93 103.15 5.92 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.225 1.81 . . . . 0.0 110.955 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 99.2 p . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.601 1.56 . . . . 0.0 114.702 -179.481 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo . . . . . 0 CA--C 1.536 0.625 0 N-CA-C 112.039 -0.024 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 m -140.08 171.27 14.41 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.959 1.703 . . . . 0.0 110.477 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -92.35 130.65 37.98 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.114 1.366 . . . . 0.0 110.252 -178.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -137.54 161.04 37.46 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.412 1.085 . . . . 0.0 112.85 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -95.41 160.01 14.73 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.491 2.317 . . . . 0.0 111.665 178.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.47 106.16 18.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.957 1.703 . . . . 0.0 110.933 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -134.48 118.42 17.32 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.994 1.718 . . . . 0.0 111.377 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -125.64 152.92 44.55 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.117 1.367 . . . . 0.0 111.464 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 19.6 t -154.51 175.49 13.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.367 1.467 . . . . 0.0 111.42 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -144.88 101.65 3.67 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.956 -1.09 . . . . 0.0 110.441 173.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.72 178.64 7.72 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.082 1.353 . . . . 0.0 113.442 -178.203 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 170.78 9.16 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 128.053 2.541 . . . . 0.0 113.661 174.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -141.69 141.13 33.33 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.067 1.747 . . . . 0.0 112.065 -176.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.6 t -101.21 140.54 35.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.817 0.847 . . . . 0.0 111.793 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.488 HG23 HD22 ' A' ' 104' ' ' ASN . 15.5 m -146.58 -179.41 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 126.452 1.901 . . . . 0.0 111.251 -176.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.2 m -125.96 116.27 21.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.815 1.246 . . . . 0.0 111.04 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 m -85.29 132.32 34.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.594 0.634 . . . . 0.0 111.289 173.368 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -136.72 116.28 12.88 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 125.188 1.395 . . . . 0.0 108.323 174.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.6 m120 57.87 55.98 5.04 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.86 1.264 . . . . 0.0 112.38 -170.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.33 25.18 12.13 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 127.439 2.295 . . . . 0.0 115.072 169.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.09 132.71 5.33 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.844 1.257 . . . . 0.0 109.787 -174.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.99 106.71 2.3 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 124.008 3.139 . . . . 0.0 113.5 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.3 m -108.65 14.95 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.888 2.075 . . . . 0.0 112.619 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -151.66 143.91 24.02 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.612 -1.305 . . . . 0.0 111.672 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -100.63 132.68 45.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 111.425 176.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.1 t -107.85 -53.52 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.908 0.883 . . . . 0.0 111.982 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.64 -172.5 44.28 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-N 118.93 0.786 . . . . 0.0 114.504 -173.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -126.18 128.88 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.479 1.511 . . . . 0.0 109.722 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.58 2.92 8.3 Favored Glycine 0 CA--C 1.539 1.555 0 N-CA-C 116.354 1.302 . . . . 0.0 116.354 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -168.88 163.39 11.61 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 128.555 2.742 . . . . 0.0 110.232 -176.034 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.1 m . . . . . 0 CA--C 1.539 0.55 0 C-N-CA 125.733 1.613 . . . . 0.0 109.848 170.161 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 CA--C 1.541 0.614 0 CA-C-O 121.978 0.894 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.442 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.2 t-105 -55.37 -36.74 66.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.727 1.611 . . . . 0.0 111.406 167.169 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.81 -32.34 70.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.907 1.283 . . . . 0.0 112.465 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.1 p -97.94 -24.72 15.26 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.763 1.225 . . . . 0.0 113.737 175.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -52.85 -40.21 63.2 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.768 1.627 . . . . 0.0 112.992 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -58.08 -61.59 2.44 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.779 0.832 . . . . 0.0 111.196 172.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.93 -28.73 38.79 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 tmtm? -66.42 -44.84 81.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.676 1.59 . . . . 0.0 114.042 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -155.72 21.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.8 mt -127.59 146.52 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 120.145 -1.597 . . . . 0.0 109.412 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.45 154.64 43.15 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -88.89 2.1 54.3 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.949 1.7 . . . . 0.0 112.343 168.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.83 106.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.387 1.875 . . . . 0.0 111.409 174.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 ttp-105 -67.23 114.73 6.2 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.494 -1.379 . . . . 0.0 110.178 171.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -126.98 5.26 6.52 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.255 1.422 . . . . 0.0 113.293 176.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.52 HG22 ' H ' ' A' ' 67' ' ' CYS . 14.9 p -71.37 150.3 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.24 1.416 . . . . 0.0 113.125 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -132.62 3.3 3.84 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.012 1.725 . . . . 0.0 112.877 173.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.52 ' H ' HG22 ' A' ' 65' ' ' VAL 0.251 90.2 m 45.65 57.66 4.84 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.743 2.417 . . . . 0.0 112.083 -171.606 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -156.34 -43.69 0.07 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.585 2.354 . . . . 0.0 111.736 -163.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -113.47 0.02 14.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.714 2.005 . . . . 0.0 113.573 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.2 pt -60.65 -11.03 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.21 1.404 . . . . 0.0 113.966 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -25.76 29.21 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 167.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 t -89.4 -2.54 58.44 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.557 1.543 . . . . 0.0 113.794 176.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 p -108.82 -179.52 3.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.904 1.682 . . . . 0.0 111.51 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -69.45 -14.58 62.96 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 172.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -81.63 6.43 15.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.348 1.859 . . . . 0.0 114.743 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -65.23 -5.03 5.98 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 128.413 2.685 . . . . 0.0 115.237 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -62.56 -2.32 1.06 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.676 1.99 . . . . 0.0 115.25 -173.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 8.5 t 56.14 31.9 19.13 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.169 1.788 . . . . 0.0 113.263 -173.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.36 154.46 20.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.482 1.113 . . . . 0.0 112.03 176.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -63.64 -33.61 76.0 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.007 1.323 . . . . 0.0 113.692 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -164.43 160.21 20.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.097 1.759 . . . . 0.0 112.123 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t30 -138.26 123.62 19.42 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.227 1.011 . . . . 0.0 110.422 172.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 42.0 m -87.37 94.74 9.77 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.842 0.857 . . . . 0.0 109.428 173.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -78.75 132.85 37.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.002 -0.436 . . . . 0.0 111.1 172.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.1 mt -111.8 113.44 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.55 1.54 . . . . 0.0 107.966 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -85.82 84.39 7.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.89 -0.506 . . . . 0.0 110.522 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.0 m -141.2 159.03 43.07 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.998 1.319 . . . . 0.0 113.249 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -71.41 162.71 71.29 Favored Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 124.739 1.216 . . . . 0.0 111.363 162.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.22 -23.73 28.38 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.556 2.171 . . . . 0.0 114.355 176.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -60.86 -58.23 20.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-N 119.68 1.127 . . . . 0.0 112.884 -177.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.89 0.89 5.08 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.034 2.489 . . . . 0.0 114.93 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.54 -57.4 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 126.937 2.095 . . . . 0.0 110.156 177.467 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -40.03 79.67 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.335 -0.853 . . . . 0.0 112.708 -177.711 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.81 -3.5 44.82 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 62.2 mt -52.84 -36.36 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.777 0.717 . . . . 0.0 110.529 169.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.63 159.58 16.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.3 1.04 . . . . 0.0 113.081 174.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -156.0 104.99 2.32 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.535 1.534 . . . . 0.0 110.646 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.63 5.1 87.03 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.299 0.952 . . . . 0.0 114.99 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.7 mt -75.28 115.87 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.534 1.167 . . . . 0.0 111.155 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.2 mt -111.54 -11.92 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 126.629 1.972 . . . . 0.0 110.946 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 4.3 5.09 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.438 2.295 . . . . 0.0 116.007 -171.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 51.81 68.28 0.83 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.805 1.642 . . . . 0.0 113.041 -170.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -156.48 163.57 39.25 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.133 1.773 . . . . 0.0 111.018 176.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.488 HD22 HG23 ' A' ' 16' ' ' VAL . 6.8 t-20 -143.52 -165.37 2.08 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.884 -1.135 . . . . 0.0 111.338 163.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.21 146.83 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 125.448 1.499 . . . . 0.0 109.285 165.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.0 tp -50.96 142.11 12.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.623 1.169 . . . . 0.0 111.409 167.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.19 174.32 0.94 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 171.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -117.19 -32.55 4.96 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.769 1.228 . . . . 0.0 113.529 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -78.76 176.01 9.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.519 1.927 . . . . 0.0 112.325 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -121.81 111.03 16.63 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.099 -1.001 . . . . 0.0 111.49 -177.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -107.95 160.33 15.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.203 1.801 . . . . 0.0 109.935 -174.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -70.91 110.78 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.687 -0.633 . . . . 0.0 110.845 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.16 126.87 50.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.813 1.645 . . . . 0.0 110.981 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.3 t -132.23 96.9 3.98 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.686 1.194 . . . . 0.0 109.961 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -103.6 135.66 44.76 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.157 1.383 . . . . 0.0 110.16 -178.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 22.1 m -116.83 146.25 43.01 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.936 -1.102 . . . . 0.0 108.646 168.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -134.94 124.42 24.89 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.035 0.934 . . . . 0.0 109.344 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.3 t -58.01 147.37 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.015 0.926 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.7 t -136.45 86.11 2.2 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 122.782 1.277 . . . . 0.0 112.836 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 61.3 m . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.198 1.799 . . . . 0.0 112.784 173.739 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo . . . . . 0 CA--C 1.54 0.779 0 N-CA-C 112.784 0.263 . . . . 0.0 112.784 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 85.9 m -140.4 168.27 20.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.575 2.35 . . . . 0.0 109.599 176.104 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -93.45 140.44 29.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.324 1.05 . . . . 0.0 110.22 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -137.64 160.86 38.02 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.699 1.2 . . . . 0.0 112.46 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -94.46 153.74 17.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.741 2.016 . . . . 0.0 112.01 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.18 103.59 16.25 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.381 1.473 . . . . 0.0 111.22 -174.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -133.64 118.83 18.64 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.143 1.377 . . . . 0.0 111.456 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -129.51 152.22 49.29 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.04 1.736 . . . . 0.0 110.942 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.8 m -155.23 175.11 14.28 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.92 1.688 . . . . 0.0 111.43 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -144.71 104.77 4.06 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.936 -1.103 . . . . 0.0 110.838 175.051 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -169.77 172.17 6.91 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.916 1.286 . . . . 0.0 113.405 -171.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 172.86 1.09 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 128.329 2.652 . . . . 0.0 114.224 168.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -141.17 143.01 33.98 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.639 1.975 . . . . 0.0 111.7 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.4 t -103.49 138.85 39.63 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.069 0.947 . . . . 0.0 111.097 176.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.5 m -145.45 -179.49 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 125.905 1.682 . . . . 0.0 111.435 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.6 m -126.22 117.44 23.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.608 1.163 . . . . 0.0 111.527 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.87 130.08 34.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.832 0.853 . . . . 0.0 111.201 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -138.95 112.6 8.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.064 1.346 . . . . 0.0 108.925 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.1 m120 58.82 58.51 3.21 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.154 1.382 . . . . 0.0 112.331 -172.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 62.84 27.64 16.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 127.27 2.228 . . . . 0.0 114.841 171.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.75 133.51 5.49 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.983 1.313 . . . . 0.0 109.767 -176.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 101.04 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 124.149 3.232 . . . . 0.0 112.308 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 m -96.21 1.26 10.38 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 C-N-CA 125.11 1.364 . . . . 0.0 112.447 -178.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -143.82 139.83 29.53 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 121.357 1.89 . . . . 0.0 110.997 -171.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -88.38 145.38 25.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.155 0.582 . . . . 0.0 110.294 172.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 73.6 t -114.43 -57.37 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.735 0.814 . . . . 0.0 111.426 173.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.09 -174.79 43.83 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 123.981 0.8 . . . . 0.0 112.509 -172.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.73 132.61 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.588 0.755 . . . . 0.0 112.118 -173.481 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.08 0.19 14.04 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 115.287 0.875 . . . . 0.0 115.287 -173.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 96.2 p -173.81 167.83 4.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.684 2.794 . . . . 0.0 110.321 -172.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.1 m . . . . . 0 CA--C 1.54 0.591 0 C-N-CA 125.122 1.369 . . . . 0.0 110.707 172.603 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 p30 . . . . . 0 CA--C 1.541 0.617 0 CA-C-O 123.259 1.504 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.2 t-105 -55.97 -33.61 64.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.066 1.746 . . . . 0.0 112.863 171.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -44.52 92.71 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.09 -1.006 . . . . 0.0 111.039 -178.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.8 p -81.49 -24.7 36.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.503 1.521 . . . . 0.0 114.563 173.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -51.3 -43.59 61.71 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.211 1.404 . . . . 0.0 112.126 174.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -57.89 -63.08 1.37 Allowed 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 124.596 1.158 . . . . 0.0 110.922 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -21.52 53.29 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.72 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -65.98 -48.74 70.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.354 1.461 . . . . 0.0 114.431 174.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -152.36 19.96 0.64 Allowed 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.1 mt -125.63 149.98 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.768 1.627 . . . . 0.0 108.527 177.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -144.51 156.86 44.37 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.453 0.644 . . . . 0.0 112.532 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -93.0 4.35 54.16 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.716 1.606 . . . . 0.0 112.16 169.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 t -160.73 111.76 1.83 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.647 1.979 . . . . 0.0 111.015 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.0 ttp85 -67.08 101.72 0.91 Allowed 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.564 -1.335 . . . . 0.0 110.557 172.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -113.85 4.42 15.87 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.654 1.582 . . . . 0.0 113.2 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.5 p -72.43 141.67 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.682 1.193 . . . . 0.0 112.427 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -128.7 7.94 5.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.476 1.91 . . . . 0.0 112.698 172.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.5 m 49.87 47.12 23.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.054 2.542 . . . . 0.0 113.685 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -163.0 -28.46 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.029 2.531 . . . . 0.0 111.86 179.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 27.0 p30 -105.93 0.7 26.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.465 1.506 . . . . 0.0 113.853 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 pt -60.94 -11.69 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.035 1.334 . . . . 0.0 113.686 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -23.69 28.85 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.3 p -96.11 -4.9 41.99 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.5 p -97.04 -176.01 3.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.824 1.65 . . . . 0.0 111.476 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -64.75 -18.02 64.67 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 170.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -92.7 11.79 25.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.99 1.716 . . . . 0.0 114.145 -169.08 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -63.57 -8.46 9.78 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.823 2.449 . . . . 0.0 115.229 -175.535 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -62.75 -7.44 4.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.504 1.921 . . . . 0.0 114.71 -173.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.2 t 38.38 61.24 1.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.947 2.099 . . . . 0.0 113.653 -166.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 161.23 26.98 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.881 1.273 . . . . 0.0 112.11 160.477 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.25 -32.25 73.55 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.512 1.525 . . . . 0.0 114.525 -172.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -161.84 160.2 27.83 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 169.682 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -135.03 118.69 17.06 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.836 0.854 . . . . 0.0 110.888 171.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 25.8 m -81.84 95.55 7.35 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.036 0.534 . . . . 0.0 109.708 172.55 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 -80.94 131.05 35.31 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.811 -0.556 . . . . 0.0 111.892 175.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.2 mt -106.76 115.24 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 125.38 1.472 . . . . 0.0 107.779 173.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -88.21 92.53 9.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.044 0.449 . . . . 0.0 109.89 167.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.2 t -147.44 -173.7 4.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.635 1.174 . . . . 0.0 112.999 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -99.91 162.53 20.75 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 128.368 2.667 . . . . 0.0 110.995 172.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.0 -25.23 23.11 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.431 2.087 . . . . 0.0 114.244 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -58.41 18.36 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.036 -177.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -69.3 0.35 5.42 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.336 2.69 . . . . 0.0 114.831 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.5 t -102.33 -58.66 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.85 2.06 . . . . 0.0 110.001 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.27 -38.86 82.17 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.319 -0.863 . . . . 0.0 112.777 -177.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.99 -4.49 47.29 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.5 mt -53.23 -35.02 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.858 0.754 . . . . 0.0 110.798 170.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.7 p -113.24 158.08 20.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.005 1.322 . . . . 0.0 113.077 174.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -153.93 104.73 2.69 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.942 1.697 . . . . 0.0 110.373 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.84 4.97 88.41 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.206 0.908 . . . . 0.0 114.986 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.4 mt -76.35 118.82 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 118.607 1.203 . . . . 0.0 111.131 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 3.3 mt -115.69 -6.36 11.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 126.943 2.097 . . . . 0.0 110.829 173.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.04 7.93 4.41 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.383 2.273 . . . . 0.0 115.682 -172.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 85.2 p 50.43 61.48 3.18 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.867 1.667 . . . . 0.0 113.912 -174.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -157.58 154.17 28.07 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 126.284 1.833 . . . . 0.0 110.54 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -137.99 -169.81 2.64 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.095 -1.003 . . . . 0.0 111.63 166.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.4 p -122.63 144.38 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.671 1.588 . . . . 0.0 109.354 169.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.6 tp -52.51 141.79 19.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.526 1.131 . . . . 0.0 111.49 169.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.31 172.25 1.57 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 121.923 0.868 . . . . 0.0 113.265 172.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.3 t -117.67 -30.69 5.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.817 1.247 . . . . 0.0 113.263 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.6 m -78.85 170.72 16.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.464 1.506 . . . . 0.0 112.15 177.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -118.51 108.12 14.61 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.577 1.151 . . . . 0.0 111.063 -176.401 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -100.8 161.55 13.52 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.61 1.564 . . . . 0.0 110.324 -173.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -70.38 108.34 4.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.735 -0.603 . . . . 0.0 110.125 179.086 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.35 130.4 47.52 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 124.695 1.198 . . . . 0.0 111.888 -175.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.9 t -135.93 95.36 3.2 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.096 0.959 . . . . 0.0 110.85 -172.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -86.54 162.56 17.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.723 0.773 . . . . 0.0 111.162 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.72 135.15 16.08 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.482 1.113 . . . . 0.0 108.975 157.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -120.46 130.43 54.3 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.063 1.345 . . . . 0.0 110.442 -176.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.5 145.54 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 124.006 0.922 . . . . 0.0 111.925 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.8 t -135.41 78.21 1.71 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.681 1.192 . . . . 0.0 112.354 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.253 1.254 0 C-N-CA 126.185 1.794 . . . . 0.0 112.924 172.853 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo . . . . . 0 CA--C 1.538 0.721 0 N-CA-C 113.329 0.473 . . . . 0.0 113.329 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.38 179.67 6.65 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.224 2.209 . . . . 0.0 110.275 -176.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -109.87 127.52 54.76 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.237 1.415 . . . . 0.0 110.373 175.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -137.91 163.62 31.02 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.531 1.132 . . . . 0.0 113.36 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.1 mtpt -104.24 157.63 17.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.59 2.356 . . . . 0.0 111.626 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.58 113.7 25.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.385 1.874 . . . . 0.0 110.84 -177.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -136.13 102.63 5.07 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.842 1.257 . . . . 0.0 113.092 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -102.61 146.07 28.72 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.285 1.434 . . . . 0.0 111.368 173.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.1 m -145.69 169.69 17.97 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.227 1.811 . . . . 0.0 111.183 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.5 m -144.44 104.32 4.06 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 120.87 -1.144 . . . . 0.0 111.039 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -170.34 173.12 5.83 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.02 1.328 . . . . 0.0 113.163 -170.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.61 175.63 1.04 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.359 2.264 . . . . 0.0 114.315 169.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -143.66 144.76 32.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.221 1.809 . . . . 0.0 111.755 177.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.5 t -104.6 141.32 36.62 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.446 1.098 . . . . 0.0 110.847 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.474 HG23 HD22 ' A' ' 104' ' ' ASN . 16.6 m -148.24 -178.31 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.024 1.73 . . . . 0.0 111.738 -173.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -127.98 115.82 19.11 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.129 1.372 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.67 132.62 34.12 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.545 0.738 . . . . 0.0 111.857 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -135.85 117.2 14.64 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.441 1.496 . . . . 0.0 108.453 173.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.7 m120 56.45 56.29 5.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.744 1.218 . . . . 0.0 112.357 -171.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 65.21 25.21 12.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 127.496 2.318 . . . . 0.0 115.038 169.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.93 132.34 5.21 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.784 1.234 . . . . 0.0 109.723 -174.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.71 109.81 2.97 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.595 2.863 . . . . 0.0 113.468 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.2 m -108.84 17.19 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.606 1.963 . . . . 0.0 112.686 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -153.8 144.67 22.67 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.635 -1.29 . . . . 0.0 111.871 174.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -88.25 149.23 23.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.574 0.749 . . . . 0.0 110.056 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 81.9 t -124.5 -45.86 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.657 0.783 . . . . 0.0 112.515 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.29 -179.39 48.23 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 118.98 0.809 . . . . 0.0 114.12 -175.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 p -132.36 118.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.54 1.536 . . . . 0.0 110.704 -172.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.21 2.28 58.59 Favored Glycine 0 CA--C 1.541 1.694 0 C-N-CA 124.139 0.876 . . . . 0.0 114.909 -172.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 94.0 p -173.77 169.19 4.23 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.466 2.706 . . . . 0.0 110.097 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.7 m . . . . . 0 CA--C 1.538 0.506 0 C-N-CA 124.888 1.275 . . . . 0.0 109.085 165.264 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 CA--C 1.542 0.64 0 CA-C-O 122.462 1.125 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -60.05 -34.81 73.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.732 1.613 . . . . 0.0 113.075 177.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -44.38 96.62 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.578 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.0 p -79.54 -26.76 41.36 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -52.38 -43.23 64.61 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.858 1.663 . . . . 0.0 112.889 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -57.46 -61.45 2.48 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.409 1.084 . . . . 0.0 110.813 174.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.52 -26.95 56.22 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -49.75 68.74 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.313 1.445 . . . . 0.0 114.441 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -149.57 20.57 0.92 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -174.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -127.85 147.48 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.323 . . . . 0.0 109.566 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.12 154.58 43.33 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -87.63 0.68 55.32 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.05 1.74 . . . . 0.0 112.54 167.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.5 t -164.02 105.02 0.9 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.364 1.866 . . . . 0.0 111.202 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.2 ttp85 -67.41 105.81 1.91 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.558 -1.339 . . . . 0.0 110.934 173.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -117.75 3.75 12.28 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.527 1.531 . . . . 0.0 113.116 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.9 t -79.01 143.27 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.799 1.24 . . . . 0.0 111.66 -175.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -131.96 6.42 4.28 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.746 1.619 . . . . 0.0 113.313 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.2 m 50.43 46.72 24.98 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.838 2.055 . . . . 0.0 113.751 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -152.34 -29.14 0.16 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 127.118 2.167 . . . . 0.0 113.049 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -105.05 -2.72 24.05 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.307 1.443 . . . . 0.0 113.733 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -60.26 -12.52 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.656 1.582 . . . . 0.0 114.304 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -32.34 56.16 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.911 0.884 . . . . 0.0 112.018 167.332 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.8 t -88.7 -6.44 57.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.781 1.632 . . . . 0.0 114.461 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.4 p -109.73 -174.52 2.52 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.209 1.403 . . . . 0.0 112.191 -176.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -62.04 -20.83 64.38 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 120.917 -1.115 . . . . 0.0 113.618 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -94.67 17.4 13.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.157 1.783 . . . . 0.0 113.509 -169.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -67.57 -8.44 34.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.479 2.312 . . . . 0.0 114.72 -172.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -62.15 -3.62 1.36 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.973 2.509 . . . . 0.0 115.312 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.5 t 52.33 34.23 14.48 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.254 2.222 . . . . 0.0 115.054 176.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.26 164.31 5.53 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.503 1.921 . . . . 0.0 113.453 171.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -62.99 -39.59 95.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.948 1.299 . . . . 0.0 113.979 -173.121 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -161.02 164.79 30.69 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.487 1.515 . . . . 0.0 112.631 171.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -131.4 147.19 52.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.276 1.03 . . . . 0.0 109.952 164.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 47.3 m -107.3 92.55 4.12 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.183 1.393 . . . . 0.0 109.436 176.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -80.16 124.83 29.13 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.695 0.798 . . . . 0.0 111.708 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.0 mt -99.68 117.55 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.769 1.628 . . . . 0.0 108.432 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -87.56 86.35 7.2 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.573 -0.704 . . . . 0.0 110.53 169.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.0 m -142.9 156.96 45.0 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.381 1.473 . . . . 0.0 112.965 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -71.47 162.94 70.09 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 124.699 1.199 . . . . 0.0 110.585 163.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.02 -23.39 29.65 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.076 1.851 . . . . 0.0 114.52 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -61.25 -57.64 24.34 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.059 -0.972 . . . . 0.0 113.036 -177.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.68 0.32 5.75 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.035 2.49 . . . . 0.0 114.949 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.8 t -102.78 -54.45 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.527 1.931 . . . . 0.0 109.813 176.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -45.6 76.86 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.214 -0.929 . . . . 0.0 112.712 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.96 -2.93 32.8 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 -172.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.34 -36.23 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.501 0.72 . . . . 0.0 110.376 169.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.09 158.24 17.58 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.218 1.007 . . . . 0.0 113.172 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -155.97 101.51 2.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.129 1.771 . . . . 0.0 109.992 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 2.98 79.86 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.58 1.086 . . . . 0.0 114.88 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.2 mt -73.52 116.07 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.615 1.207 . . . . 0.0 111.249 -178.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.4 mt -108.8 -13.11 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 110.874 171.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.67 5.64 2.99 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 127.623 2.369 . . . . 0.0 116.298 -169.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.9 t 52.08 64.34 1.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.446 1.499 . . . . 0.0 112.661 -172.127 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -155.02 160.43 41.05 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.992 1.717 . . . . 0.0 111.262 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASN . . . . . 0.474 HD22 HG23 ' A' ' 16' ' ' VAL . 6.5 t-20 -144.67 -166.73 2.47 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.682 -1.262 . . . . 0.0 111.509 163.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.62 148.68 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 125.654 1.582 . . . . 0.0 109.589 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.01 142.16 25.87 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 111.476 168.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.27 172.67 2.36 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 122.558 1.17 . . . . 0.0 113.46 171.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 18.1 p -115.89 -36.83 4.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.407 1.883 . . . . 0.0 112.93 -176.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.1 m -74.52 171.7 13.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.556 1.942 . . . . 0.0 112.708 177.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -119.54 105.01 10.81 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.588 1.155 . . . . 0.0 111.31 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -98.29 162.6 13.1 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.866 1.666 . . . . 0.0 110.309 -175.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -71.51 107.38 4.38 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.726 -0.609 . . . . 0.0 110.11 177.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -100.58 129.76 46.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.49 1.116 . . . . 0.0 111.53 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 29.5 t -130.28 94.11 3.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.436 1.494 . . . . 0.0 109.497 -172.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -87.95 164.23 15.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.398 1.094 . . . . 0.0 110.663 170.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 11.5 m -129.57 168.29 16.63 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.958 1.303 . . . . 0.0 109.096 153.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -144.43 124.21 13.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.168 -0.958 . . . . 0.0 109.632 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.6 p -55.07 146.15 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 123.916 0.887 . . . . 0.0 112.473 177.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -131.85 80.65 1.93 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.283 1.433 . . . . 0.0 111.003 174.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.2 m . . . . . 0 C--O 1.253 1.276 0 C-N-CA 127.266 2.226 . . . . 0.0 113.567 178.655 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 118.557 -0.735 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.74 -52.54 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.765 1.643 . . . . 0.0 113.07 -176.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.26 178.21 7.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.417 1.887 . . . . 0.0 110.391 -176.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -105.64 126.81 52.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.641 1.177 . . . . 0.0 110.28 -178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -133.48 155.99 48.56 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.874 1.27 . . . . 0.0 111.694 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -100.67 153.63 19.27 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.865 1.666 . . . . 0.0 112.302 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.37 112.48 19.37 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.702 1.601 . . . . 0.0 111.788 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -132.34 119.54 20.86 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.851 1.66 . . . . 0.0 110.936 174.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -132.08 150.2 52.22 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.516 1.526 . . . . 0.0 110.895 171.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.9 t -149.93 174.92 12.15 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.163 1.385 . . . . 0.0 111.705 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -141.18 104.03 4.55 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.417 -0.802 . . . . 0.0 111.004 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.7 p30 -165.91 173.16 10.8 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.947 1.299 . . . . 0.0 113.038 -172.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.7 173.2 2.94 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.856 2.063 . . . . 0.0 113.427 169.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -143.15 155.88 44.66 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.402 1.881 . . . . 0.0 110.422 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.9 t -113.62 145.94 40.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.237 1.415 . . . . 0.0 111.778 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -148.67 -179.3 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 126.314 1.845 . . . . 0.0 111.774 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.9 m -124.85 119.15 28.02 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.273 1.429 . . . . 0.0 111.893 174.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.5 t -85.44 131.15 34.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.508 1.123 . . . . 0.0 111.5 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -139.53 112.53 8.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.489 1.116 . . . . 0.0 109.303 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 58.66 58.22 3.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.33 1.452 . . . . 0.0 112.421 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.44 25.55 13.35 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.583 2.353 . . . . 0.0 114.83 169.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.46 134.91 5.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.093 1.357 . . . . 0.0 109.701 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.29 111.06 3.19 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.696 2.931 . . . . 0.0 113.705 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.458 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.3 m -109.85 16.09 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 126.35 1.86 . . . . 0.0 112.761 -179.212 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -152.64 137.01 16.67 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.712 -1.242 . . . . 0.0 110.621 177.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -79.72 152.41 29.89 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 168.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.1 t -126.67 -47.53 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.594 0.758 . . . . 0.0 112.824 174.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.45 -174.69 46.89 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.474 1.034 . . . . 0.0 115.103 -175.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 41.3 t -125.75 121.25 59.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 109.799 -174.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 63.74 4.39 10.17 Favored Glycine 0 CA--C 1.542 1.768 0 N-CA-C 115.981 1.152 . . . . 0.0 115.981 -175.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -168.32 163.98 12.95 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.747 2.419 . . . . 0.0 110.54 -177.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.7 m -105.77 113.2 26.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.05 1.74 . . . . 0.0 111.129 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.0 119.7 5.28 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.007 1.289 . . . . 0.0 112.637 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.1 m -56.49 135.47 54.37 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.353 1.861 . . . . 0.0 113.559 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -103.92 14.61 52.54 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.68 1.609 . . . . 0.0 115.62 -173.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.2 32.76 0.94 Allowed Glycine 0 CA--C 1.54 1.636 0 C-N-CA 126.596 2.046 . . . . 0.0 116.591 -172.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 75.4 m -134.7 167.55 20.64 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.638 1.975 . . . . 0.0 111.928 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.91 15.22 6.48 Favored Glycine 0 CA--C 1.54 1.6 0 C-N-CA 125.665 1.602 . . . . 0.0 116.087 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 66.0 mt -64.53 139.5 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 126.048 1.739 . . . . 0.0 110.657 -176.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -139.06 17.87 2.62 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.71 1.604 . . . . 0.0 113.06 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.7 mt -75.41 -17.87 60.07 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.845 -1.159 . . . . 0.0 112.59 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -74.25 170.32 15.81 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.882 1.673 . . . . 0.0 112.942 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 91.4 m -74.48 -25.93 59.69 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.467 -0.771 . . . . 0.0 112.966 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.3 p 42.83 62.5 1.75 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.061 2.144 . . . . 0.0 114.626 -177.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.0 mp -65.44 -4.22 5.42 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 114.9 1.445 . . . . 0.0 114.9 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.5 p -60.7 -39.63 89.24 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.078 1.351 . . . . 0.0 114.033 174.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -119.3 108.73 14.97 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.117 1.367 . . . . 0.0 111.003 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.24 0.33 61.53 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.098 1.332 . . . . 0.0 115.201 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.1 m -137.53 -169.47 2.53 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.035 1.417 . . . . 0.0 111.408 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -154.55 172.18 18.23 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.879 1.672 . . . . 0.0 109.64 -174.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.458 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.5 t-105 -55.59 -37.22 67.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.826 1.65 . . . . 0.0 111.274 167.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -26.24 63.52 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.212 1.805 . . . . 0.0 113.123 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.8 p -107.8 -24.55 11.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.653 1.581 . . . . 0.0 113.815 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -50.19 -42.29 50.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.476 1.91 . . . . 0.0 112.666 171.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -56.22 -63.03 1.32 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.698 1.199 . . . . 0.0 110.785 173.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -58.87 -27.02 64.78 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -62.36 -54.12 45.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.667 1.187 . . . . 0.0 113.141 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.8 p80 -147.75 22.64 1.13 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -176.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -124.8 150.03 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.532 -1.355 . . . . 0.0 109.446 175.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.7 t -145.19 150.73 37.26 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -84.08 -1.14 54.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.572 1.549 . . . . 0.0 112.92 168.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -162.43 108.2 1.22 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.271 1.829 . . . . 0.0 111.312 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -68.35 108.84 3.38 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.219 -1.55 . . . . 0.0 110.806 172.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -114.45 5.78 15.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.646 1.578 . . . . 0.0 112.569 171.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -74.5 136.09 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.258 1.423 . . . . 0.0 111.562 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -125.56 3.83 7.59 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.054 1.741 . . . . 0.0 113.147 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 21.6 m 56.83 30.96 18.72 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.151 2.18 . . . . 0.0 114.651 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -146.09 -19.03 0.45 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.334 2.654 . . . . 0.0 112.929 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.31 -2.59 16.64 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.793 1.637 . . . . 0.0 113.478 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.5 pt -65.36 -4.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 125.505 1.522 . . . . 0.0 114.021 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 23.4 ptm -54.22 -28.01 38.21 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.524 1.129 . . . . 0.0 113.665 159.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.5 t -87.69 -26.94 22.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.444 1.497 . . . . 0.0 113.458 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.7 p -87.94 -178.55 6.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.866 1.266 . . . . 0.0 111.934 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -65.47 -16.0 63.21 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.932 -1.105 . . . . 0.0 113.634 176.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -90.75 19.07 5.75 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.485 1.914 . . . . 0.0 113.929 -173.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -67.47 -7.84 28.75 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.025 2.13 . . . . 0.0 114.348 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -61.99 -0.87 0.55 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 128.239 2.616 . . . . 0.0 115.882 -173.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 t 49.57 51.63 16.06 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.112 1.765 . . . . 0.0 113.182 -176.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 167.35 2.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.896 1.278 . . . . 0.0 112.52 170.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -76.78 -30.03 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.833 1.253 . . . . 0.0 112.622 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.31 169.32 17.64 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.711 2.004 . . . . 0.0 111.325 168.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -143.95 161.86 37.64 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.045 0.938 . . . . 0.0 110.396 159.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.6 m -124.01 92.3 3.64 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.153 1.381 . . . . 0.0 110.247 -177.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -78.6 121.51 24.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.248 1.019 . . . . 0.0 111.262 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.3 mt -94.43 116.05 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 124.759 1.224 . . . . 0.0 107.962 171.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -86.64 90.77 8.37 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.662 -0.649 . . . . 0.0 109.83 167.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 57.7 p -145.52 170.72 15.84 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.132 1.373 . . . . 0.0 112.494 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -78.25 163.46 61.97 Favored Pre-proline 0 N--CA 1.475 0.792 0 C-N-CA 124.367 1.067 . . . . 0.0 109.951 164.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.68 -24.44 18.42 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.167 1.912 . . . . 0.0 113.987 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.85 -55.39 46.16 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.328 -177.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.32 -1.73 8.61 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.097 2.531 . . . . 0.0 114.844 179.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 t -99.01 -54.69 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 126.212 1.805 . . . . 0.0 109.54 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.22 -45.59 80.18 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.766 0.827 . . . . 0.0 112.887 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.26 -3.72 38.05 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -171.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.0 mt -54.36 -35.46 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 123.456 0.703 . . . . 0.0 110.507 171.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 p -109.32 158.34 17.98 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.761 1.224 . . . . 0.0 113.17 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -155.92 108.44 2.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.941 1.696 . . . . 0.0 110.561 177.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.01 1.48 86.71 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 124.533 1.063 . . . . 0.0 114.977 -178.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -75.1 119.88 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.932 1.293 . . . . 0.0 111.298 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.16 -13.05 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 126.624 1.97 . . . . 0.0 110.993 173.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.86 3.68 4.97 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 127.428 2.291 . . . . 0.0 116.46 -168.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 54.08 64.55 1.79 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.469 1.507 . . . . 0.0 112.601 -172.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -158.66 152.04 22.91 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.601 1.96 . . . . 0.0 110.486 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -136.63 -169.32 2.43 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.906 -1.121 . . . . 0.0 110.835 163.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.3 p -122.71 150.82 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 125.314 1.446 . . . . 0.0 109.185 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.3 tp -50.91 138.91 18.18 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.841 0.856 . . . . 0.0 111.255 167.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.45 176.06 0.68 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.053 0.941 . . . . 0.0 111.679 173.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -117.65 -26.99 6.4 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.788 -1.195 . . . . 0.0 113.936 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -87.9 169.32 12.12 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.394 1.477 . . . . 0.0 112.38 -174.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -114.3 103.53 11.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.051 -1.031 . . . . 0.0 111.667 -174.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -98.96 158.42 15.66 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.172 1.789 . . . . 0.0 110.422 -176.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.93 106.54 3.68 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.763 -0.586 . . . . 0.0 110.549 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -95.56 123.2 38.99 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.202 1.001 . . . . 0.0 111.662 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.6 t -123.19 88.51 2.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.903 1.681 . . . . 0.0 110.927 -174.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -81.19 162.64 23.52 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.785 0.802 . . . . 0.0 111.693 168.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -152.26 127.87 10.09 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 125.104 1.362 . . . . 0.0 108.251 162.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -119.96 137.46 54.05 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.801 1.24 . . . . 0.0 110.001 -173.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.6 t -61.52 148.14 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-O 121.514 0.673 . . . . 0.0 112.365 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.9 t -137.18 94.39 2.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.081 1.352 . . . . 0.0 110.996 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.171 1.788 . . . . 0.0 112.506 178.558 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.21 -46.78 0.28 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 121.732 1.621 . . . . 0.0 113.107 -167.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.12 171.91 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.91 2.084 . . . . 0.0 109.619 -177.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -102.33 129.7 48.85 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.285 1.034 . . . . 0.0 110.31 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -133.31 156.26 47.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 111.871 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.97 151.98 20.72 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.074 1.35 . . . . 0.0 112.457 175.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -74.6 120.96 20.86 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.713 1.605 . . . . 0.0 111.805 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -142.24 116.12 9.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.927 1.691 . . . . 0.0 110.207 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -133.22 147.43 51.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.924 1.69 . . . . 0.0 111.002 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.7 t -154.51 175.23 13.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.544 1.538 . . . . 0.0 111.549 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -139.41 101.19 4.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.473 1.109 . . . . 0.0 110.318 171.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.02 179.54 7.91 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.592 1.157 . . . . 0.0 113.52 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.1 170.98 10.39 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 128.336 2.654 . . . . 0.0 113.732 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -142.35 141.3 32.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.06 1.744 . . . . 0.0 112.008 -176.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.6 t -102.09 142.66 33.0 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.038 0.923 . . . . 0.0 111.619 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.532 HG23 HD22 ' A' ' 104' ' ' ASN . 14.4 m -147.24 -178.7 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.559 1.944 . . . . 0.0 111.241 -175.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.0 m -125.72 117.71 24.05 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.177 -0.952 . . . . 0.0 111.525 174.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.09 131.51 34.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.783 0.833 . . . . 0.0 111.413 174.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -140.32 111.44 7.08 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.126 1.37 . . . . 0.0 108.562 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 59.9 56.79 3.33 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.409 1.484 . . . . 0.0 112.456 -169.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.41 24.66 13.24 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.723 2.409 . . . . 0.0 115.102 169.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.66 133.05 5.69 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 125.142 1.377 . . . . 0.0 109.445 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -76.42 105.55 2.1 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.874 3.05 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.429 HG12 ' N ' ' A' ' 51' ' ' TRP . 5.7 m -101.96 15.46 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.714 1.606 . . . . 0.0 112.102 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 16.6 t-80 -156.79 146.45 20.73 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 120.216 1.371 . . . . 0.0 112.759 -175.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -101.12 135.62 42.3 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.601 1.16 . . . . 0.0 111.391 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 99.6 t -110.16 -53.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.016 0.926 . . . . 0.0 112.018 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.53 -174.23 45.35 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 119.006 0.821 . . . . 0.0 114.459 -174.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 t -123.54 127.62 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 109.511 -176.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.82 4.51 7.34 Favored Glycine 0 CA--C 1.542 1.777 0 N-CA-C 116.376 1.311 . . . . 0.0 116.376 -176.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.3 t -167.87 160.82 12.65 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.269 2.228 . . . . 0.0 111.111 -175.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 86.9 m -108.27 107.74 18.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.222 1.809 . . . . 0.0 110.998 172.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.28 67.77 3.56 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.921 1.248 . . . . 0.0 113.785 -176.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.6 t -69.37 157.18 37.54 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.599 1.16 . . . . 0.0 112.589 174.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.87 -168.99 31.56 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 125.259 1.409 . . . . 0.0 115.066 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 125.51 -99.35 0.56 Allowed Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.741 1.639 . . . . 0.0 113.283 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.9 p -147.58 165.77 29.35 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.706 1.602 . . . . 0.0 112.594 -174.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.09 48.98 3.67 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 126.013 1.768 . . . . 0.0 115.411 -171.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.6 mm -75.0 145.44 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 125.655 1.582 . . . . 0.0 110.992 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 25.7 p90 -138.28 7.68 2.64 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.893 1.677 . . . . 0.0 113.66 -178.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.1 mt -73.16 -13.15 61.11 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.002 1.721 . . . . 0.0 113.298 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -67.12 165.25 16.28 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.467 1.507 . . . . 0.0 113.376 179.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 49.2 m -68.1 -33.94 75.47 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.805 0.842 . . . . 0.0 111.967 174.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.8 t 46.45 59.36 3.9 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.418 1.887 . . . . 0.0 113.544 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -55.25 -15.85 2.77 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.03 1.732 . . . . 0.0 115.017 -177.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.3 t -53.5 -31.69 47.12 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.989 1.716 . . . . 0.0 113.633 166.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.19 111.22 15.63 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.77 1.628 . . . . 0.0 111.111 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.92 5.02 71.49 Favored Glycine 0 CA--C 1.539 1.579 0 C-N-CA 124.539 1.066 . . . . 0.0 115.205 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.01 -167.25 2.18 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.219 1.408 . . . . 0.0 111.343 172.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -153.48 172.77 16.62 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.762 1.625 . . . . 0.0 110.126 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.429 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -56.24 -37.95 70.45 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.613 1.965 . . . . 0.0 111.875 166.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.1 90.29 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.941 1.297 . . . . 0.0 111.797 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.6 p -83.1 -30.84 27.64 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.316 1.446 . . . . 0.0 113.411 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -53.27 -38.68 63.29 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.68 1.592 . . . . 0.0 113.111 176.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -59.29 -62.73 1.67 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.744 0.818 . . . . 0.0 110.702 171.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -58.62 -23.94 59.98 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -64.35 -48.06 76.95 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.376 1.87 . . . . 0.0 113.257 177.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -155.15 25.19 0.42 Allowed 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.688 1.736 . . . . 0.0 115.688 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.3 mt -128.8 147.78 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.111 -1.618 . . . . 0.0 109.612 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.3 t -146.99 159.38 43.63 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -96.46 4.1 52.35 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 126.626 1.97 . . . . 0.0 112.494 168.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.0 t -161.98 115.76 1.85 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.305 1.842 . . . . 0.0 110.898 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttp-105 -67.36 106.2 2.01 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.574 -1.329 . . . . 0.0 110.724 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -115.51 3.56 14.07 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.293 1.437 . . . . 0.0 113.567 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 p -72.18 143.51 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.708 1.203 . . . . 0.0 112.368 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -130.38 6.54 4.87 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.06 1.744 . . . . 0.0 112.782 170.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.6 m 51.5 38.62 22.63 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.843 2.457 . . . . 0.0 113.962 -177.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -154.67 -27.76 0.12 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.112 2.565 . . . . 0.0 112.895 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -107.61 1.69 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.771 1.629 . . . . 0.0 113.527 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.2 pt -59.86 -13.46 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.43 1.492 . . . . 0.0 113.662 176.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -53.77 -26.05 21.82 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.065 1.346 . . . . 0.0 114.259 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -91.3 -13.23 32.99 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.082 1.353 . . . . 0.0 113.645 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.6 p -93.45 -176.0 3.97 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.792 1.637 . . . . 0.0 112.051 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -64.19 -18.39 64.45 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 169.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -93.16 11.36 28.07 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.011 1.724 . . . . 0.0 114.261 -167.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -64.98 -6.33 8.3 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 128.764 2.825 . . . . 0.0 115.01 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -62.35 -2.39 1.01 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.845 2.058 . . . . 0.0 114.805 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t 53.84 34.04 18.41 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.456 1.902 . . . . 0.0 113.874 -175.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 155.63 12.24 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.881 1.672 . . . . 0.0 112.242 174.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -71.13 -26.67 63.11 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.4 pttt -164.82 165.83 20.22 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 112.236 167.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -137.41 163.65 30.55 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.199 1.0 . . . . 0.0 111.554 166.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.0 m -127.76 92.1 3.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.275 1.43 . . . . 0.0 110.0 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.56 122.86 25.21 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.774 0.83 . . . . 0.0 110.848 175.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.9 mt -99.59 116.23 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.035 1.334 . . . . 0.0 107.812 174.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -89.37 87.35 7.07 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.313 0.578 . . . . 0.0 110.539 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 93.8 p -148.94 166.39 28.75 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.136 1.375 . . . . 0.0 112.602 171.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 30.1 mtt85 -74.17 161.72 77.08 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 124.715 1.206 . . . . 0.0 111.528 170.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.51 -22.32 38.8 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.305 2.003 . . . . 0.0 114.457 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -58.01 17.04 Favored Pre-proline 0 N--CA 1.473 0.72 0 CA-C-N 119.605 1.093 . . . . 0.0 112.714 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.77 -0.57 5.49 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 123.138 2.559 . . . . 0.0 114.94 178.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.4 t -101.14 -55.56 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 126.426 1.89 . . . . 0.0 109.7 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -45.53 81.26 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.087 -1.008 . . . . 0.0 112.971 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.59 -2.9 31.35 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -172.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.3 mt -53.44 -35.63 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.664 0.786 . . . . 0.0 110.468 169.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.5 p -110.38 159.23 17.65 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.63 1.172 . . . . 0.0 113.235 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -156.44 103.11 2.12 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.162 1.785 . . . . 0.0 110.005 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.5 3.55 81.17 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.596 1.093 . . . . 0.0 114.961 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.4 mt -75.31 116.48 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 118.63 1.215 . . . . 0.0 111.241 -178.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.4 mt -110.37 -13.44 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.516 1.926 . . . . 0.0 111.079 173.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.74 2.62 5.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 127.38 2.272 . . . . 0.0 116.298 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t 52.27 67.58 0.95 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.79 1.636 . . . . 0.0 112.507 -170.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -155.14 156.47 35.81 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.646 1.978 . . . . 0.0 110.878 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.532 HD22 HG23 ' A' ' 16' ' ' VAL . 6.1 t-20 -140.72 -171.93 3.34 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.752 -1.218 . . . . 0.0 111.702 162.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.0 t -123.78 139.85 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.647 1.579 . . . . 0.0 108.452 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 34.0 tp -48.44 140.31 8.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.624 1.17 . . . . 0.0 111.893 170.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.45 174.06 0.81 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 174.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.5 t -122.48 -21.59 5.71 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.803 1.241 . . . . 0.0 114.201 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.8 m -86.25 171.47 11.23 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.25 1.42 . . . . 0.0 111.765 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -119.01 109.85 16.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.107 0.963 . . . . 0.0 111.26 -176.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -105.09 159.93 15.45 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 110.295 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.74 108.83 3.56 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.153 0.502 . . . . 0.0 110.35 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.91 121.28 41.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.347 1.459 . . . . 0.0 111.202 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.6 t -125.25 90.44 3.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.106 1.363 . . . . 0.0 110.717 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -80.97 161.09 24.44 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.547 0.739 . . . . 0.0 110.864 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -150.44 134.71 17.09 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 120.937 -1.102 . . . . 0.0 108.185 156.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.99 141.03 52.14 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.051 1.34 . . . . 0.0 109.228 -174.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.5 t -63.36 148.96 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-O 121.701 0.763 . . . . 0.0 112.114 -177.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.3 t -139.68 85.94 2.07 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.955 1.302 . . . . 0.0 111.874 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.252 1.198 0 C-N-CA 126.533 1.933 . . . . 0.0 113.709 178.633 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 118.606 -0.712 . . . . 0.0 111.378 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.98 -47.53 1.77 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.138 1.892 . . . . 0.0 112.263 175.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -138.98 176.14 8.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.308 1.843 . . . . 0.0 110.353 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -95.27 127.34 41.24 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.568 1.147 . . . . 0.0 110.2 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -135.39 159.25 42.16 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.563 1.145 . . . . 0.0 111.957 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.33 151.68 25.67 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.907 1.683 . . . . 0.0 112.722 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.63 110.22 12.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.204 1.802 . . . . 0.0 111.742 -172.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -134.11 117.7 16.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.587 1.555 . . . . 0.0 111.372 177.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -132.35 151.6 51.79 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.806 1.643 . . . . 0.0 111.406 173.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -152.75 177.04 11.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.114 1.366 . . . . 0.0 112.012 176.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -144.41 103.98 4.03 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.044 0.938 . . . . 0.0 111.058 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.3 p30 -169.58 172.6 6.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.375 1.47 . . . . 0.0 113.224 -173.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.12 171.86 1.19 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 127.585 2.354 . . . . 0.0 114.355 168.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -142.65 146.27 34.3 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.559 1.944 . . . . 0.0 111.597 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.0 t -106.5 142.46 36.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.088 0.955 . . . . 0.0 111.63 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -147.14 -179.53 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.471 1.908 . . . . 0.0 111.697 -174.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.42 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.7 m -126.42 119.81 28.18 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.225 -0.922 . . . . 0.0 111.818 174.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.4 t -85.17 128.83 34.82 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.34 1.056 . . . . 0.0 111.341 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -136.5 113.31 10.3 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.023 1.329 . . . . 0.0 108.988 176.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.3 m120 58.27 57.83 3.76 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.985 1.314 . . . . 0.0 112.453 -172.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.98 26.25 14.08 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.398 2.279 . . . . 0.0 114.763 170.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.53 134.16 5.96 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 124.94 1.296 . . . . 0.0 109.516 -177.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -75.32 105.46 2.09 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.698 2.932 . . . . 0.0 112.228 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.437 HG12 ' H ' ' A' ' 51' ' ' TRP . 9.9 m -99.41 11.8 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.26 1.424 . . . . 0.0 111.968 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.42 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 21.5 t-80 -155.75 142.25 18.63 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.114 1.325 . . . . 0.0 112.595 -170.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -98.02 137.6 36.59 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.391 1.076 . . . . 0.0 111.351 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.6 t -111.3 -55.49 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.133 0.973 . . . . 0.0 112.028 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.57 -173.65 43.24 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 118.983 0.811 . . . . 0.0 115.123 -171.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.9 t -127.54 124.03 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.874 1.67 . . . . 0.0 110.051 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.04 3.96 10.08 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.0 p -168.96 163.98 11.47 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.647 2.379 . . . . 0.0 110.924 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -105.44 106.43 16.93 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.112 1.365 . . . . 0.0 110.611 172.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.15 90.81 1.15 Allowed Glycine 0 CA--C 1.531 1.058 0 C-N-CA 125.436 1.493 . . . . 0.0 112.011 -178.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 t -125.24 168.05 14.01 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.044 1.338 . . . . 0.0 112.398 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.76 -176.42 45.91 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 125.395 1.474 . . . . 0.0 114.068 -172.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 116.33 -85.11 0.38 Allowed Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.579 1.561 . . . . 0.0 113.126 175.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 52.5 m -140.92 166.23 25.34 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.481 1.512 . . . . 0.0 112.493 -174.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -77.93 45.5 2.5 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 126.027 1.775 . . . . 0.0 114.76 -178.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.3 mt -70.38 142.74 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 126.06 1.744 . . . . 0.0 110.145 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -135.91 6.66 3.16 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.699 1.6 . . . . 0.0 113.725 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.4 -8.53 55.47 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.835 1.654 . . . . 0.0 112.643 178.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -59.56 167.92 1.81 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.493 1.917 . . . . 0.0 112.787 168.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.3 m -70.02 -27.19 64.47 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.417 -0.802 . . . . 0.0 112.633 178.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 91.8 p 51.26 38.86 22.51 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.533 1.933 . . . . 0.0 115.298 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.09 -24.03 9.21 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.081 1.352 . . . . 0.0 114.315 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.9 p -52.62 -31.95 39.27 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 126.562 1.945 . . . . 0.0 114.765 171.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.98 104.44 8.57 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.018 1.727 . . . . 0.0 111.919 176.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.35 -3.8 50.98 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.484 1.516 . . . . 0.0 115.245 178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -131.67 -163.58 1.35 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.261 1.424 . . . . 0.0 111.134 172.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -156.1 173.39 16.89 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.926 1.691 . . . . 0.0 109.687 -175.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.437 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.4 t-105 -55.45 -37.94 68.4 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.705 2.002 . . . . 0.0 112.063 167.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -42.34 83.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.827 1.251 . . . . 0.0 111.329 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -87.82 -27.57 22.19 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.568 1.547 . . . . 0.0 114.084 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -50.48 -42.86 55.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.934 1.694 . . . . 0.0 112.782 173.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.67 -62.45 1.72 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.454 1.102 . . . . 0.0 110.797 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -60.31 -23.03 63.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -178.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -64.57 -52.58 56.89 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.34 1.456 . . . . 0.0 113.163 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -149.95 22.64 0.87 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -175.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -125.69 150.08 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 120.362 -1.461 . . . . 0.0 109.246 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.6 t -145.39 152.58 40.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -84.31 -1.81 55.97 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.156 1.782 . . . . 0.0 112.963 168.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -163.65 114.71 1.37 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.391 1.876 . . . . 0.0 111.178 176.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -66.59 105.87 1.64 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.348 -1.47 . . . . 0.0 110.683 173.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -115.18 1.29 13.81 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.275 1.43 . . . . 0.0 113.595 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.435 HG22 ' H ' ' A' ' 67' ' ' CYS . 7.7 p -72.3 143.04 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.818 1.247 . . . . 0.0 112.229 178.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -130.77 12.66 5.31 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.123 1.769 . . . . 0.0 112.226 170.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.435 ' H ' HG22 ' A' ' 65' ' ' VAL . 6.4 m 51.67 38.41 22.67 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.905 2.482 . . . . 0.0 112.704 -173.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -147.86 -43.01 0.16 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.808 2.443 . . . . 0.0 112.519 -168.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.4 p30 -93.0 -6.26 48.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.141 1.377 . . . . 0.0 113.347 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.9 pt -63.34 -10.78 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.509 1.124 . . . . 0.0 113.492 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -56.38 -19.78 16.38 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.887 1.275 . . . . 0.0 114.128 164.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.3 t -114.76 -2.33 13.02 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.425 1.89 . . . . 0.0 113.78 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.5 p -98.52 -174.37 2.79 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.122 1.369 . . . . 0.0 110.886 172.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -64.02 -18.08 63.97 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.801 -1.187 . . . . 0.0 113.622 173.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -94.53 14.03 22.12 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.867 1.667 . . . . 0.0 114.275 -165.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -66.32 -4.16 7.39 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 128.514 2.726 . . . . 0.0 114.922 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -62.96 -2.9 1.36 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.651 1.98 . . . . 0.0 115.16 -174.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.8 t 57.17 32.26 21.41 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.938 1.695 . . . . 0.0 113.596 -176.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.21 155.27 25.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.103 1.361 . . . . 0.0 112.334 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -64.62 -30.99 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -170.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.25 164.17 22.54 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.015 1.726 . . . . 0.0 111.407 166.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -128.78 159.26 36.25 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.184 0.593 . . . . 0.0 110.159 161.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.1 m -122.05 93.51 4.01 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.828 1.251 . . . . 0.0 109.578 173.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -78.25 128.0 33.08 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.563 0.745 . . . . 0.0 111.114 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.1 mt -103.4 111.77 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.385 1.474 . . . . 0.0 107.447 173.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -80.62 88.83 5.69 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.728 -0.608 . . . . 0.0 109.69 168.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 71.1 m -149.21 159.31 44.36 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.069 1.348 . . . . 0.0 112.849 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -73.39 162.75 72.88 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 124.641 1.176 . . . . 0.0 110.35 166.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.8 -23.13 30.97 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.135 1.89 . . . . 0.0 114.428 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.97 -56.84 27.99 Favored Pre-proline 0 N--CA 1.474 0.744 0 CA-C-O 117.974 -1.013 . . . . 0.0 113.183 -176.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.69 -1.12 7.87 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.982 2.455 . . . . 0.0 114.863 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.2 t -100.81 -54.32 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.282 1.833 . . . . 0.0 109.668 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -44.79 79.41 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.225 -0.922 . . . . 0.0 112.969 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.25 -4.2 37.62 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -172.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.7 mt -53.08 -35.22 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.876 0.87 . . . . 0.0 110.799 170.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.6 p -112.53 158.07 20.38 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.271 1.429 . . . . 0.0 113.315 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -154.83 107.79 2.81 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.56 1.944 . . . . 0.0 109.803 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.56 3.24 88.51 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.411 1.005 . . . . 0.0 114.957 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 51.1 mt -76.43 117.62 21.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.887 1.275 . . . . 0.0 111.037 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.98 -12.04 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 126.729 2.012 . . . . 0.0 110.964 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 3.7 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.325 2.25 . . . . 0.0 116.12 -170.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.26 67.93 0.9 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.736 1.614 . . . . 0.0 113.062 -171.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -158.53 153.56 25.25 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.164 1.786 . . . . 0.0 110.717 177.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -138.46 -170.91 2.93 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.822 -1.174 . . . . 0.0 111.128 165.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.0 t -125.59 139.85 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.431 1.492 . . . . 0.0 108.578 173.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.0 tp -48.77 139.72 9.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.502 1.121 . . . . 0.0 111.947 170.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.25 172.33 1.51 Allowed 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 174.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -120.09 -24.47 6.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.701 1.201 . . . . 0.0 113.996 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -82.07 172.68 12.94 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.233 1.413 . . . . 0.0 112.089 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -119.16 105.36 11.3 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.595 1.158 . . . . 0.0 111.382 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -100.61 162.29 13.03 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.0 1.72 . . . . 0.0 110.854 -174.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -73.49 105.37 4.81 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.759 -0.588 . . . . 0.0 110.506 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.83 123.09 39.25 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.741 1.216 . . . . 0.0 111.471 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 42.4 t -127.05 91.2 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.006 1.322 . . . . 0.0 110.892 -174.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -83.95 164.39 19.41 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.682 0.753 . . . . 0.0 111.591 169.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -154.2 119.87 5.21 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.192 -0.943 . . . . 0.0 109.025 161.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -107.66 139.46 42.17 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.325 1.05 . . . . 0.0 110.239 -174.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.14 149.55 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.174 0.589 . . . . 0.0 112.198 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.1 t -142.14 95.06 2.74 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 122.099 0.952 . . . . 0.0 112.667 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.864 2.066 . . . . 0.0 113.952 179.127 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 . . . . . 0 N--CA 1.488 1.438 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.767 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.45 -47.33 0.24 Allowed 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.594 1.53 . . . . 0.0 111.989 169.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -144.84 -178.11 5.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.774 2.029 . . . . 0.0 110.742 -174.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -105.45 127.08 52.8 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.352 1.461 . . . . 0.0 110.418 177.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -134.34 164.29 27.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.888 1.275 . . . . 0.0 112.23 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -116.04 153.29 31.95 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.793 2.037 . . . . 0.0 112.646 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.33 113.99 22.07 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.475 1.91 . . . . 0.0 111.577 -168.014 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -137.87 103.06 4.88 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.641 1.576 . . . . 0.0 112.424 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -117.35 140.98 48.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.079 1.351 . . . . 0.0 111.279 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -147.2 165.68 29.3 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.648 1.579 . . . . 0.0 111.484 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -140.21 103.67 4.64 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.614 -0.679 . . . . 0.0 111.209 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -171.48 170.7 5.72 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.803 1.241 . . . . 0.0 113.248 -169.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 171.62 1.45 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.571 2.349 . . . . 0.0 113.89 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.5 p90 -141.83 147.0 36.51 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.336 1.854 . . . . 0.0 111.453 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.6 t -105.45 144.31 32.39 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.839 0.856 . . . . 0.0 111.063 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.8 m -148.36 -178.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.336 1.855 . . . . 0.0 111.804 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -128.09 117.66 22.03 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.022 1.329 . . . . 0.0 111.877 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 18.7 t -85.32 129.43 34.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.467 1.107 . . . . 0.0 111.729 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -135.61 114.1 11.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 125.021 1.329 . . . . 0.0 109.113 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.5 m120 57.46 57.25 4.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.876 1.27 . . . . 0.0 112.445 -172.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.4 26.18 13.5 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.458 2.303 . . . . 0.0 114.745 170.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.01 134.29 5.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.111 1.365 . . . . 0.0 109.709 -177.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.55 110.08 3.03 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 123.551 2.834 . . . . 0.0 113.351 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.457 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.4 m -108.01 17.03 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 126.42 1.888 . . . . 0.0 112.347 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -153.8 141.3 19.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.66 -1.275 . . . . 0.0 111.113 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -84.69 154.23 22.6 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.124 0.57 . . . . 0.0 110.274 169.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.1 t -130.1 -44.6 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.04 -174.96 47.23 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 119.74 1.155 . . . . 0.0 115.262 -174.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -130.79 116.67 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.03 1.732 . . . . 0.0 110.024 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.34 3.29 31.06 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 115.17 0.828 . . . . 0.0 115.17 -174.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 98.4 p -167.9 167.6 12.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 128.156 2.582 . . . . 0.0 110.387 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 78.4 m -107.2 119.82 40.44 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.256 1.422 . . . . 0.0 110.34 171.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.12 114.5 6.61 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.816 1.198 . . . . 0.0 112.042 174.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.6 p -61.39 138.57 58.26 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.779 1.632 . . . . 0.0 112.937 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -81.79 36.46 2.49 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.648 1.594 . . . . 0.0 115.258 -173.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -78.81 -63.79 2.04 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.932 1.253 . . . . 0.0 113.446 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.8 m -67.71 160.16 28.64 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.004 1.322 . . . . 0.0 113.323 -177.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.84 19.12 12.54 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 125.838 1.685 . . . . 0.0 116.046 -176.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 53.0 mt -63.22 133.79 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.641 1.576 . . . . 0.0 110.704 -175.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -145.36 20.53 1.54 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.542 1.537 . . . . 0.0 113.272 -178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.51 -11.96 60.13 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.589 -1.319 . . . . 0.0 112.866 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -68.11 167.62 13.69 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.844 1.657 . . . . 0.0 113.482 177.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 50.2 m -64.23 -34.17 77.48 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.357 1.063 . . . . 0.0 112.432 176.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.9 t 43.47 71.89 0.21 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.658 2.383 . . . . 0.0 114.363 -176.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.5 mp -67.6 2.8 1.63 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 126.062 1.745 . . . . 0.0 115.061 -178.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.2 t -60.96 -39.09 88.23 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.242 1.417 . . . . 0.0 113.103 177.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.05 113.69 18.09 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.243 1.417 . . . . 0.0 110.805 -175.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.54 0.8 64.5 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.922 1.248 . . . . 0.0 115.076 -177.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 18.1 m -138.36 -172.12 3.21 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.233 1.413 . . . . 0.0 111.202 175.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -153.93 173.25 16.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.794 1.638 . . . . 0.0 109.663 -175.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.457 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -56.48 -37.41 70.32 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 126.076 1.751 . . . . 0.0 111.734 168.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.63 -37.62 76.31 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.486 1.114 . . . . 0.0 111.731 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -90.94 -27.1 18.93 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.599 1.16 . . . . 0.0 113.926 175.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -51.07 -43.01 60.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 126.136 1.774 . . . . 0.0 113.036 174.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -56.4 -62.21 1.88 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.507 1.123 . . . . 0.0 110.961 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.59 -27.49 62.76 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.8 tptt -65.11 -51.02 63.74 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.019 1.328 . . . . 0.0 113.726 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -148.84 22.82 0.99 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -128.3 147.94 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.11 1.364 . . . . 0.0 109.434 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.4 t -147.88 154.36 40.3 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -85.65 1.51 48.97 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.21 1.804 . . . . 0.0 113.112 167.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.6 t -162.38 104.19 1.1 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.685 1.994 . . . . 0.0 110.953 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -67.33 109.06 2.98 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.546 -1.346 . . . . 0.0 110.121 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.81 5.69 17.64 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.305 1.442 . . . . 0.0 113.005 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -77.2 139.3 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.871 1.268 . . . . 0.0 111.898 -174.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -127.36 7.86 6.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.096 1.758 . . . . 0.0 112.819 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 m 53.03 37.26 24.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.424 2.29 . . . . 0.0 113.816 -178.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -151.03 -33.36 0.16 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.831 2.452 . . . . 0.0 111.853 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -97.52 -5.25 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.852 1.661 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.7 pt -62.32 -12.21 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.947 1.299 . . . . 0.0 113.633 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -55.68 -33.39 64.09 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.738 0.815 . . . . 0.0 112.387 168.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -77.54 -12.57 59.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.263 1.425 . . . . 0.0 114.207 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -100.49 -175.36 2.89 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.539 1.536 . . . . 0.0 112.422 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -63.34 -19.95 65.08 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -94.25 12.79 25.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.783 1.633 . . . . 0.0 114.199 -165.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -64.68 -5.79 6.47 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 128.999 2.919 . . . . 0.0 115.136 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -62.32 -2.06 0.91 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.739 2.016 . . . . 0.0 114.919 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.8 t 55.98 31.46 18.0 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.101 1.76 . . . . 0.0 113.981 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 156.81 24.37 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.847 1.659 . . . . 0.0 112.527 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -63.23 -34.13 76.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.654 1.182 . . . . 0.0 114.155 -171.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.4 ptmm? -162.64 160.57 25.87 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.913 1.685 . . . . 0.0 112.473 168.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -129.85 159.01 37.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.029 0.932 . . . . 0.0 110.152 161.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.9 m -123.7 92.73 3.74 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.164 1.386 . . . . 0.0 109.503 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -79.48 121.85 25.71 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.166 0.986 . . . . 0.0 111.168 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.9 mt -97.25 117.25 41.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.242 1.417 . . . . 0.0 107.897 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -89.05 90.81 8.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.249 0.547 . . . . 0.0 110.294 167.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.0 p -144.67 172.04 13.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.337 1.455 . . . . 0.0 112.311 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -79.3 164.27 55.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 124.434 1.094 . . . . 0.0 109.779 164.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 -22.88 22.03 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.179 1.92 . . . . 0.0 114.284 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.24 -54.97 49.92 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-O 118.018 -0.991 . . . . 0.0 113.293 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.95 -1.28 8.36 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.236 2.624 . . . . 0.0 114.785 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 15.7 t -99.7 -53.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 126.141 1.776 . . . . 0.0 109.708 175.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -45.37 78.83 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.36 -0.837 . . . . 0.0 112.869 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.36 -3.54 37.42 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.3 mt -53.83 -36.19 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 123.514 0.726 . . . . 0.0 110.491 170.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.2 p -108.92 158.04 18.07 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.798 1.239 . . . . 0.0 113.031 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -156.2 104.84 2.27 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.657 1.583 . . . . 0.0 110.785 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 1.84 81.36 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.656 1.122 . . . . 0.0 115.002 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.66 119.91 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.899 1.279 . . . . 0.0 111.237 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.3 mt -112.27 -13.19 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.591 1.956 . . . . 0.0 110.927 173.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.93 4.14 5.77 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.441 2.296 . . . . 0.0 116.341 -168.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 53.2 68.16 0.88 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.646 1.579 . . . . 0.0 112.998 -171.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -159.83 152.86 21.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.161 1.784 . . . . 0.0 110.907 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -141.65 -170.24 3.07 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.817 -1.177 . . . . 0.0 111.524 166.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.92 142.62 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.747 1.619 . . . . 0.0 108.656 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.1 tp -51.12 140.66 15.7 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.229 1.011 . . . . 0.0 111.721 168.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.77 172.93 1.46 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -118.42 -31.47 4.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.872 1.269 . . . . 0.0 113.354 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.5 m -74.3 170.54 15.39 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.701 1.601 . . . . 0.0 112.334 175.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -120.34 102.31 8.39 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.326 1.051 . . . . 0.0 111.601 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -95.27 161.57 14.04 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.081 1.752 . . . . 0.0 110.978 -175.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -74.63 101.35 4.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.726 0.81 . . . . 0.0 110.53 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -96.1 128.8 43.33 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.943 1.297 . . . . 0.0 112.3 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.9 t -129.6 96.09 4.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.783 1.633 . . . . 0.0 110.672 -173.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -94.17 157.34 16.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.845 0.831 . . . . 0.0 111.585 172.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -147.43 117.86 7.43 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.271 1.028 . . . . 0.0 109.474 167.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -106.36 138.12 43.11 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.632 1.173 . . . . 0.0 110.099 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.9 t -61.15 146.92 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.673 0.789 . . . . 0.0 111.624 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 5.7 t -137.91 88.56 2.33 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.894 1.33 . . . . 0.0 111.39 174.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.343 1.857 . . . . 0.0 112.935 175.046 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -81.1 -51.05 0.05 OUTLIER 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 122.276 1.984 . . . . 0.0 114.453 -161.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.2 m -127.62 160.4 31.74 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.171 1.788 . . . . 0.0 109.782 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.0 140.55 29.38 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.509 1.124 . . . . 0.0 110.136 173.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -138.93 159.75 41.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.057 1.343 . . . . 0.0 112.32 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -92.67 156.22 17.21 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.144 2.178 . . . . 0.0 111.948 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -89.7 113.4 24.89 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.271 1.828 . . . . 0.0 111.128 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -137.16 93.06 2.78 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.884 1.274 . . . . 0.0 111.929 174.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -109.07 136.18 49.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.017 1.327 . . . . 0.0 110.758 177.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 m -143.46 171.46 14.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.591 1.556 . . . . 0.0 111.737 -174.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -143.54 104.68 4.25 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.137 -0.977 . . . . 0.0 111.439 175.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.6 p30 -171.52 172.72 4.97 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.112 1.365 . . . . 0.0 113.332 -169.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.37 173.42 1.57 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.551 2.34 . . . . 0.0 114.233 168.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -142.88 147.53 35.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.759 2.024 . . . . 0.0 111.51 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -107.25 142.55 36.83 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.028 0.931 . . . . 0.0 111.501 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.534 HG23 HD22 ' A' ' 104' ' ' ASN . 16.1 m -147.98 -178.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 126.305 1.842 . . . . 0.0 111.65 -174.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.4 m -127.06 119.69 27.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.115 0.966 . . . . 0.0 111.195 174.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.73 132.73 34.03 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.708 0.803 . . . . 0.0 111.365 174.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -137.08 118.23 14.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.365 1.466 . . . . 0.0 108.488 174.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.8 m120 56.37 55.44 6.61 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.65 1.18 . . . . 0.0 112.495 -171.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.54 25.16 11.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.675 2.39 . . . . 0.0 115.038 169.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.11 133.33 6.1 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 124.779 1.232 . . . . 0.0 109.439 -175.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.0 104.57 1.93 Allowed 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.848 3.032 . . . . 0.0 112.163 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.439 HG12 ' H ' ' A' ' 51' ' ' TRP . 7.7 m -102.05 14.59 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.394 1.478 . . . . 0.0 112.194 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.417 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 18.3 t-80 -156.59 142.59 18.0 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 120.111 1.323 . . . . 0.0 112.259 -173.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -97.58 141.19 30.92 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.258 1.023 . . . . 0.0 111.216 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 78.0 t -115.71 -53.86 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.057 0.943 . . . . 0.0 112.208 177.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.8 -172.78 42.64 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 119.122 0.874 . . . . 0.0 115.089 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -128.5 122.25 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 126.006 1.722 . . . . 0.0 110.034 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.82 1.46 12.03 Favored Glycine 0 CA--C 1.541 1.672 0 N-CA-C 115.856 1.102 . . . . 0.0 115.856 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.6 t -169.08 164.63 11.29 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.879 2.472 . . . . 0.0 110.316 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.6 m -104.58 111.54 24.26 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.841 1.657 . . . . 0.0 111.174 173.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.63 80.51 1.44 Allowed Glycine 0 CA--C 1.532 1.11 0 C-N-CA 125.101 1.334 . . . . 0.0 112.732 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -64.36 120.49 12.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.557 1.143 . . . . 0.0 111.659 174.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.8 -168.13 40.56 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 124.324 0.964 . . . . 0.0 114.329 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 161.56 -99.37 0.17 Allowed Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.683 1.135 . . . . 0.0 112.364 176.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.1 m -138.85 159.42 42.17 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.857 1.663 . . . . 0.0 111.436 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.37 40.97 2.23 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 125.602 1.572 . . . . 0.0 115.029 -175.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 25.1 mm -89.94 157.81 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.909 1.684 . . . . 0.0 110.687 -175.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -138.01 8.07 2.72 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.171 1.388 . . . . 0.0 114.197 -173.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.9 -11.45 60.0 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.065 1.346 . . . . 0.0 112.507 -178.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -64.69 164.15 12.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.577 1.151 . . . . 0.0 112.195 169.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.5 m -68.22 -33.79 75.05 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.623 -0.673 . . . . 0.0 112.168 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.5 t 48.61 59.54 4.29 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.222 1.809 . . . . 0.0 112.827 -178.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mp -60.83 -13.1 13.26 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -172.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.8 p -58.22 -30.48 66.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.062 1.745 . . . . 0.0 114.469 172.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -122.74 122.5 38.89 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.856 1.662 . . . . 0.0 111.841 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.21 14.17 82.53 Favored Glycine 0 CA--C 1.537 1.44 0 C-N-CA 124.11 0.862 . . . . 0.0 115.02 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.6 m -152.01 -178.33 6.69 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.926 2.09 . . . . 0.0 110.088 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -152.0 167.62 27.84 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.883 2.073 . . . . 0.0 110.702 -168.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.439 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.8 t-105 -54.74 -36.69 65.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.427 1.891 . . . . 0.0 112.41 170.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -26.97 68.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.753 1.221 . . . . 0.0 113.06 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.7 p -89.43 -31.6 17.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.658 1.183 . . . . 0.0 113.649 167.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.01 -39.69 72.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.89 1.676 . . . . 0.0 113.11 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -57.42 -65.43 0.63 Allowed 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.435 1.094 . . . . 0.0 110.526 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -60.67 -22.33 63.78 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -61.73 -55.09 33.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.465 1.506 . . . . 0.0 113.329 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -147.88 21.96 1.12 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -172.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.0 mt -129.22 146.84 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.095 1.358 . . . . 0.0 109.695 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.9 t -147.35 153.82 40.15 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 174.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -84.73 0.86 49.05 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.088 1.755 . . . . 0.0 113.112 168.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.2 t -161.26 105.76 1.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.529 1.932 . . . . 0.0 110.932 175.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -66.99 108.34 2.56 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.545 -1.347 . . . . 0.0 110.13 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -114.44 4.38 15.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.328 1.451 . . . . 0.0 113.026 176.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.4 t -83.4 138.04 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.133 0.973 . . . . 0.0 111.437 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -124.55 8.61 8.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.127 1.771 . . . . 0.0 112.398 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.3 m 52.03 44.64 29.37 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.385 2.274 . . . . 0.0 113.26 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -160.55 -20.07 0.06 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.201 2.2 . . . . 0.0 113.718 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -106.39 -1.98 22.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.826 1.25 . . . . 0.0 113.671 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.45 -13.72 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.434 1.493 . . . . 0.0 114.195 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 4.6 ptm -51.07 -25.11 4.53 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.23 1.412 . . . . 0.0 114.587 164.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 t -95.66 -15.58 22.62 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.663 1.585 . . . . 0.0 113.584 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 p -90.39 -174.73 4.25 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.698 1.599 . . . . 0.0 112.188 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -63.38 -20.73 65.79 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.146 -0.971 . . . . 0.0 113.572 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.27 20.01 8.7 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.606 1.963 . . . . 0.0 113.424 -170.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -65.59 -10.12 32.72 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.601 2.36 . . . . 0.0 114.537 -174.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -61.8 -3.13 1.01 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.89 2.476 . . . . 0.0 115.369 -175.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.93 25.47 6.83 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.296 1.838 . . . . 0.0 114.185 -177.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 161.3 4.27 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 113.692 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -63.98 -34.81 78.84 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.472 1.509 . . . . 0.0 114.346 -168.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -165.35 158.53 16.25 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.446 1.498 . . . . 0.0 112.421 175.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -140.43 128.23 21.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.797 1.239 . . . . 0.0 110.015 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 54.2 m -91.87 94.34 9.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.679 1.192 . . . . 0.0 110.551 171.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -79.81 125.91 30.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.243 0.617 . . . . 0.0 111.175 175.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.0 mt -99.8 114.48 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.367 1.467 . . . . 0.0 108.057 172.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -84.91 87.36 7.34 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.735 -0.603 . . . . 0.0 110.109 167.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 t -152.17 171.23 18.25 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.201 1.0 . . . . 0.0 113.138 170.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -77.07 163.85 62.6 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.975 2.11 . . . . 0.0 110.852 173.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.58 -23.2 23.48 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.347 2.031 . . . . 0.0 114.408 176.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -60.15 -57.93 23.06 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 124.605 1.162 . . . . 0.0 113.211 -177.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -70.0 -0.81 7.66 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.164 2.576 . . . . 0.0 114.813 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -100.26 -55.19 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.327 1.851 . . . . 0.0 109.549 176.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -44.2 82.39 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.224 -0.922 . . . . 0.0 112.97 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.21 -4.38 38.56 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 61.7 mt -53.17 -36.01 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.713 0.805 . . . . 0.0 110.672 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 32.0 p -110.22 159.1 17.69 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.528 1.131 . . . . 0.0 113.056 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -156.35 103.77 2.18 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.623 1.569 . . . . 0.0 110.688 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.65 3.7 85.97 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.288 0.947 . . . . 0.0 114.912 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.3 mt -74.32 115.22 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.544 1.172 . . . . 0.0 111.161 -178.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.9 mt -108.43 -14.11 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.442 1.897 . . . . 0.0 110.867 171.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.42 5.76 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.732 2.413 . . . . 0.0 116.396 -169.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.2 t 51.42 65.87 1.36 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.498 1.519 . . . . 0.0 112.862 -171.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -154.89 157.06 37.23 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.206 1.803 . . . . 0.0 111.106 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.534 HD22 HG23 ' A' ' 16' ' ' VAL . 6.2 t-20 -142.29 -170.15 3.11 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.859 -1.151 . . . . 0.0 111.778 163.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.15 142.4 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.833 1.653 . . . . 0.0 108.625 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp -49.67 140.86 10.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.587 1.155 . . . . 0.0 111.945 169.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.49 172.66 1.48 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -118.06 -30.54 5.3 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.89 1.276 . . . . 0.0 113.474 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.2 m -76.91 171.5 14.66 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.801 1.64 . . . . 0.0 112.457 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -118.84 102.34 8.73 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.434 1.094 . . . . 0.0 111.667 -176.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -95.53 161.62 13.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.007 1.723 . . . . 0.0 111.135 -176.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -75.22 100.83 4.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.327 0.651 . . . . 0.0 110.537 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.24 128.99 37.28 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.203 . . . . 0.0 112.049 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 44.4 t -130.59 90.08 2.87 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 125.654 1.581 . . . . 0.0 110.074 -175.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -88.6 160.2 17.53 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.865 0.84 . . . . 0.0 111.419 171.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.3 m -147.35 142.79 27.47 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 125.586 1.554 . . . . 0.0 107.951 164.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -132.76 128.91 37.85 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.616 1.167 . . . . 0.0 109.755 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.6 t -57.77 147.22 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.962 0.905 . . . . 0.0 111.703 -176.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.65 103.61 5.28 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.158 0.983 . . . . 0.0 112.31 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.563 1.945 . . . . 0.0 113.473 179.748 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 119.129 -0.462 . . . . 0.0 111.898 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.01 -48.86 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.594 1.529 . . . . 0.0 112.538 -177.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.89 175.81 10.15 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.022 2.129 . . . . 0.0 110.119 -177.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -106.82 128.65 54.44 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.877 1.271 . . . . 0.0 110.672 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -135.22 158.19 45.01 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.78 1.232 . . . . 0.0 112.669 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.0 mtpp -89.02 155.9 19.2 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.618 2.367 . . . . 0.0 111.407 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.29 105.13 17.25 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.573 1.549 . . . . 0.0 110.513 -176.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -132.3 101.9 5.55 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.131 1.373 . . . . 0.0 112.278 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -114.08 137.51 51.63 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.608 1.563 . . . . 0.0 110.971 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.2 m -142.33 169.13 18.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.868 1.667 . . . . 0.0 111.047 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -143.54 103.79 4.14 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.077 -1.015 . . . . 0.0 111.387 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -169.83 172.16 6.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.799 1.24 . . . . 0.0 113.535 -170.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.81 170.28 0.43 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 128.974 2.909 . . . . 0.0 114.327 165.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.58 150.47 36.45 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.884 2.074 . . . . 0.0 111.395 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.1 t -112.29 146.25 38.55 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.845 0.831 . . . . 0.0 112.434 176.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.2 m -149.19 -177.31 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.596 1.958 . . . . 0.0 111.697 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.6 m -128.11 116.26 19.68 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 125.029 1.332 . . . . 0.0 111.908 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.5 t -83.91 130.24 34.91 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.101 0.96 . . . . 0.0 111.433 176.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -137.09 115.04 11.45 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.954 1.302 . . . . 0.0 108.969 174.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.5 m120 57.53 57.31 4.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.869 1.268 . . . . 0.0 112.498 -172.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 64.4 26.1 13.48 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.254 2.222 . . . . 0.0 114.734 170.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.21 134.43 5.77 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.227 1.411 . . . . 0.0 109.528 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.498 2.799 . . . . 0.0 113.317 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.8 m -106.62 16.84 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.498 1.919 . . . . 0.0 112.566 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -153.14 142.97 22.08 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.631 -1.293 . . . . 0.0 111.322 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -84.38 154.52 22.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.986 0.514 . . . . 0.0 110.419 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.3 t -124.28 -55.49 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.571 0.749 . . . . 0.0 112.339 167.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.09 -172.34 43.25 Favored Glycine 0 CA--C 1.53 1.028 0 CA-C-N 119.028 0.831 . . . . 0.0 115.104 -170.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -127.13 123.03 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.823 1.649 . . . . 0.0 110.672 -169.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.24 1.04 8.72 Favored Glycine 0 CA--C 1.541 1.66 0 C-N-CA 124.973 1.273 . . . . 0.0 115.97 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.7 m -166.09 166.6 17.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 129.912 3.285 . . . . 0.0 108.964 -174.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t -124.43 111.79 16.16 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.424 1.09 . . . . 0.0 111.181 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -96.82 147.17 18.59 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 124.506 1.05 . . . . 0.0 113.402 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.5 t -152.87 168.69 24.92 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.111 1.365 . . . . 0.0 111.851 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.18 170.54 30.27 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.612 1.577 . . . . 0.0 113.514 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -99.86 82.03 0.53 Allowed Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.407 1.479 . . . . 0.0 112.548 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.8 t -140.89 170.14 16.31 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.92 1.288 . . . . 0.0 112.557 177.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -94.47 12.99 68.12 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.614 2.054 . . . . 0.0 115.549 -173.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 50.8 mt -59.67 135.72 23.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 125.936 1.694 . . . . 0.0 111.356 -174.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -144.64 19.6 1.67 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.811 1.645 . . . . 0.0 113.209 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.6 mt -67.23 -24.62 65.84 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.508 -1.37 . . . . 0.0 113.988 -174.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -72.78 170.08 15.38 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.256 1.822 . . . . 0.0 113.799 173.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.3 m -62.14 -33.78 75.12 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 121.007 -1.058 . . . . 0.0 112.312 174.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.7 t 48.5 72.04 0.31 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 127.71 2.404 . . . . 0.0 113.846 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -68.59 0.22 4.38 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.409 1.883 . . . . 0.0 115.582 -175.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.6 p -62.11 -36.11 80.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.681 1.592 . . . . 0.0 114.214 -179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -129.06 113.77 15.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.534 1.534 . . . . 0.0 111.038 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.03 0.35 60.1 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 125.007 1.289 . . . . 0.0 115.108 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.4 m -137.52 -172.15 3.15 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.391 1.476 . . . . 0.0 111.428 175.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -154.37 172.14 18.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.879 1.672 . . . . 0.0 110.611 -175.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -56.96 -35.94 69.72 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.748 2.019 . . . . 0.0 112.297 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -32.01 70.1 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.971 1.309 . . . . 0.0 112.448 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.8 p -92.22 -28.72 16.85 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.734 1.613 . . . . 0.0 113.859 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -52.73 -45.48 67.0 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.429 1.492 . . . . 0.0 112.55 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -55.61 -60.68 3.09 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.417 1.087 . . . . 0.0 110.812 175.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 34.1 mttp -58.01 -25.26 60.87 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmtp -68.49 -54.38 17.23 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.058 1.343 . . . . 0.0 113.687 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -141.7 14.91 2.14 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.81 1.782 . . . . 0.0 115.81 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.0 mt -126.33 146.09 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 O-C-N 120.771 -1.205 . . . . 0.0 110.066 175.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -142.56 151.92 42.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.392 0.677 . . . . 0.0 112.352 170.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -87.73 0.32 55.89 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.207 1.403 . . . . 0.0 112.206 170.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 t -159.44 107.17 1.76 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.421 1.888 . . . . 0.0 110.593 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -64.35 105.41 0.92 Allowed 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.734 -1.229 . . . . 0.0 110.973 175.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -112.25 1.77 16.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.347 1.459 . . . . 0.0 113.431 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.6 p -75.22 145.52 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.087 1.355 . . . . 0.0 112.572 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -132.34 8.42 4.3 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.172 1.789 . . . . 0.0 112.782 172.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 52.1 m 51.45 37.38 19.14 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.786 2.434 . . . . 0.0 114.011 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -148.28 -22.05 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.421 2.689 . . . . 0.0 112.896 176.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -106.65 -3.37 20.72 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.564 1.546 . . . . 0.0 113.398 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.2 pt -64.37 -8.94 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 113.571 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.6 ttt -56.67 -23.28 40.66 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.153 1.381 . . . . 0.0 113.123 164.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.8 t -99.86 -3.25 32.93 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.24 1.816 . . . . 0.0 114.076 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.6 p -107.42 -176.79 3.17 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.064 1.345 . . . . 0.0 111.373 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -64.37 -17.11 63.43 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.952 -1.092 . . . . 0.0 113.463 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -92.06 17.96 8.68 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.573 1.949 . . . . 0.0 113.849 -173.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -66.61 -8.01 24.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.707 2.003 . . . . 0.0 114.27 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -60.77 -2.47 0.55 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 128.252 2.621 . . . . 0.0 115.958 -175.035 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.9 t 49.09 53.73 12.11 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.182 1.793 . . . . 0.0 113.058 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 167.38 2.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.598 1.159 . . . . 0.0 112.303 170.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -76.49 -29.26 56.78 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.839 1.255 . . . . 0.0 112.764 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? -170.33 161.43 8.13 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.485 2.314 . . . . 0.0 110.642 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -147.08 143.45 28.33 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.599 0.76 . . . . 0.0 110.819 164.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 56.2 m -90.88 115.07 27.64 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.063 1.345 . . . . 0.0 109.197 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.94 128.34 43.8 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.481 1.037 . . . . 0.0 111.042 165.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.5 mt -99.97 112.87 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.662 1.585 . . . . 0.0 107.062 174.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -86.82 92.18 8.89 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.538 -0.726 . . . . 0.0 109.636 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 83.6 p -146.84 177.18 9.32 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.633 1.573 . . . . 0.0 112.728 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.31 160.04 46.27 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.385 1.474 . . . . 0.0 110.503 164.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -72.66 -22.08 21.15 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.584 2.189 . . . . 0.0 114.305 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.37 -55.78 41.85 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 124.902 1.281 . . . . 0.0 112.369 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.56 -0.93 7.45 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.371 2.714 . . . . 0.0 115.187 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.73 -53.89 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.718 1.607 . . . . 0.0 110.003 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -43.93 81.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.258 -0.902 . . . . 0.0 112.747 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.5 -3.49 37.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -172.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 56.6 mt -53.73 -35.78 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.627 0.771 . . . . 0.0 110.332 170.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.5 p -111.26 157.51 20.05 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.856 1.263 . . . . 0.0 113.304 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -154.5 110.62 3.23 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.571 1.948 . . . . 0.0 109.756 175.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.47 88.53 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.645 1.117 . . . . 0.0 114.873 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -77.47 116.82 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.681 1.192 . . . . 0.0 111.067 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.8 mt -111.61 -11.4 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.786 2.034 . . . . 0.0 110.769 173.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.2 5.89 4.03 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.617 2.367 . . . . 0.0 116.118 -170.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.3 t 52.71 64.93 1.67 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.568 1.547 . . . . 0.0 112.975 -173.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -157.33 152.57 26.11 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 126.053 1.741 . . . . 0.0 110.721 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -138.71 -172.03 3.21 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.909 -1.119 . . . . 0.0 111.645 164.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.8 t -124.37 141.22 45.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 125.59 1.556 . . . . 0.0 108.51 173.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.7 tp -49.63 140.93 10.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.505 1.122 . . . . 0.0 111.784 170.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.68 174.11 0.86 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 174.056 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 12.5 t -122.39 -20.92 5.95 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.114 1.366 . . . . 0.0 113.762 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.4 m -85.66 171.73 11.42 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.737 1.615 . . . . 0.0 111.902 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.32 109.53 16.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.446 1.099 . . . . 0.0 111.41 -178.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -105.12 160.19 15.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.926 1.69 . . . . 0.0 110.293 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -71.67 108.79 5.19 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.708 -0.62 . . . . 0.0 110.711 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -95.66 121.96 37.92 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.573 1.149 . . . . 0.0 111.574 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.4 t -121.92 88.66 2.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.269 1.828 . . . . 0.0 109.523 -175.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -88.14 158.62 18.49 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.384 -0.823 . . . . 0.0 111.166 173.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.2 m -145.74 141.23 27.81 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.041 0.936 . . . . 0.0 108.538 162.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -133.27 128.3 35.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.211 1.405 . . . . 0.0 110.008 -173.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.8 t -59.5 145.77 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-N 118.87 0.759 . . . . 0.0 112.54 -175.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.6 t -133.02 100.19 4.81 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.777 1.631 . . . . 0.0 111.011 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 C--O 1.253 1.284 0 C-N-CA 126.564 1.945 . . . . 0.0 111.519 -178.252 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.63 -58.73 0.07 OUTLIER 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.361 2.041 . . . . 0.0 111.862 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.8 m -139.67 171.82 13.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.597 2.359 . . . . 0.0 109.813 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -91.51 137.19 32.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.716 1.207 . . . . 0.0 110.451 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -137.44 165.05 27.19 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.401 . . . . 0.0 111.94 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mtpt -98.84 159.02 15.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 127.247 2.219 . . . . 0.0 112.08 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.64 110.43 21.75 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.276 1.83 . . . . 0.0 111.583 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -135.8 115.66 13.09 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.203 1.801 . . . . 0.0 111.322 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -122.16 150.34 42.37 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.376 1.07 . . . . 0.0 111.548 176.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -150.48 170.65 18.59 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.987 1.315 . . . . 0.0 111.788 173.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -140.81 104.33 4.68 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.866 0.866 . . . . 0.0 110.963 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -168.6 172.99 7.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.146 1.378 . . . . 0.0 112.767 -172.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.85 172.21 1.39 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.41 1.884 . . . . 0.0 113.941 168.07 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -139.22 155.63 47.66 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.42 1.888 . . . . 0.0 110.161 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.5 t -113.91 146.24 40.34 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.078 1.351 . . . . 0.0 111.769 174.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.6 m -148.95 -178.45 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 126.415 1.886 . . . . 0.0 111.744 -175.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -125.51 117.73 24.24 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.96 1.304 . . . . 0.0 111.715 175.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.74 130.99 34.95 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.083 0.953 . . . . 0.0 111.503 176.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -138.51 112.66 8.61 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.127 1.371 . . . . 0.0 108.978 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.4 m120 57.92 57.81 3.94 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.914 1.286 . . . . 0.0 112.451 -172.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 63.97 26.95 14.26 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.407 2.283 . . . . 0.0 114.776 170.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -160.08 134.89 5.53 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.231 1.413 . . . . 0.0 109.744 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -75.85 109.1 2.83 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.667 2.911 . . . . 0.0 113.38 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.7 m -109.27 17.56 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.611 1.965 . . . . 0.0 112.722 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -152.68 139.18 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.576 -1.328 . . . . 0.0 110.656 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -84.49 147.88 26.83 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.954 0.502 . . . . 0.0 110.879 170.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.4 t -121.28 -54.49 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.404 0.682 . . . . 0.0 112.573 175.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.87 -173.66 43.51 Favored Glycine 0 CA--C 1.528 0.865 0 CA-C-N 119.247 0.931 . . . . 0.0 115.149 -171.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 t -129.19 118.48 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.892 1.677 . . . . 0.0 110.181 -172.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.43 4.76 25.76 Favored Glycine 0 CA--C 1.542 1.75 0 N-CA-C 115.663 1.025 . . . . 0.0 115.663 -174.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.2 p -165.82 166.0 17.98 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.625 2.37 . . . . 0.0 111.123 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.0 m -110.34 110.64 21.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.341 1.457 . . . . 0.0 110.526 172.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.92 160.99 53.76 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 123.459 0.552 . . . . 0.0 112.849 172.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.1 t -151.48 177.38 10.37 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.536 1.535 . . . . 0.0 111.647 177.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -170.64 175.06 44.57 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.296 1.426 . . . . 0.0 113.727 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -131.6 18.38 4.89 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 125.651 1.596 . . . . 0.0 115.051 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.3 m -123.88 156.84 35.52 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.842 1.657 . . . . 0.0 112.269 -175.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -81.67 49.13 4.0 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 125.53 1.538 . . . . 0.0 114.741 -173.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 49.8 mm -72.07 143.67 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.298 1.439 . . . . 0.0 111.295 -178.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -140.36 6.14 2.1 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.642 1.577 . . . . 0.0 114.278 -176.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -67.69 -22.43 65.28 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.063 1.345 . . . . 0.0 113.082 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -65.12 163.27 15.29 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.038 1.335 . . . . 0.0 112.983 169.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.4 m -66.33 -32.52 73.97 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 121.053 -1.029 . . . . 0.0 112.773 174.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.2 t 40.35 71.83 0.17 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 127.655 2.382 . . . . 0.0 113.965 -170.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.6 mp -59.57 -13.76 10.56 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 178.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.0 t -56.98 -31.87 65.5 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.992 1.717 . . . . 0.0 113.415 167.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -122.6 105.86 10.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.263 1.425 . . . . 0.0 111.406 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.62 2.91 64.9 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.926 1.251 . . . . 0.0 115.394 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.09 -168.99 2.39 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.472 1.509 . . . . 0.0 110.893 173.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 p30 -155.78 176.45 12.61 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.989 2.115 . . . . 0.0 110.627 -178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -59.74 -35.17 74.02 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 0.0 112.943 173.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -48.11 83.04 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.501 1.12 . . . . 0.0 110.977 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.8 p -74.53 -31.18 62.05 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.42 1.488 . . . . 0.0 113.481 174.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -54.79 -41.14 70.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.055 1.342 . . . . 0.0 113.068 175.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -60.43 -61.71 2.4 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.514 0.725 . . . . 0.0 110.484 173.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.12 -21.35 59.15 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -65.13 -56.53 12.41 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.235 1.814 . . . . 0.0 113.017 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -147.45 22.81 1.16 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.529 1.678 . . . . 0.0 115.529 -172.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -126.6 147.73 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.368 1.467 . . . . 0.0 109.291 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -143.36 152.75 41.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -84.24 -1.52 55.35 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.869 1.668 . . . . 0.0 112.804 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.2 t -162.32 109.73 1.33 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.337 1.855 . . . . 0.0 110.971 176.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.4 ttp85 -67.17 106.5 2.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 120.459 -1.401 . . . . 0.0 110.556 172.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.35 3.05 13.3 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.129 1.372 . . . . 0.0 113.036 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.411 HG22 ' H ' ' A' ' 67' ' ' CYS . 13.8 p -74.64 147.26 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.775 1.23 . . . . 0.0 113.168 -174.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -132.03 2.13 3.95 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.2 1.8 . . . . 0.0 113.266 174.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.411 ' H ' HG22 ' A' ' 65' ' ' VAL . 93.8 m 45.66 54.31 7.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.447 2.299 . . . . 0.0 113.346 -174.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -152.89 -29.88 0.14 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.372 2.669 . . . . 0.0 111.751 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -108.94 -4.06 17.04 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.77 1.628 . . . . 0.0 114.136 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.9 pt -61.98 -7.74 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.9 tpt -52.46 -27.8 17.59 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.277 1.431 . . . . 0.0 113.823 169.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 99.9 p -90.45 -5.14 56.44 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 p -100.43 -179.39 4.09 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.715 1.606 . . . . 0.0 111.695 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -68.92 -15.51 63.51 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.93 5.77 18.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.319 1.848 . . . . 0.0 114.849 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -63.14 -8.19 7.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.939 2.496 . . . . 0.0 115.207 -174.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -62.07 -5.68 2.4 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.446 1.898 . . . . 0.0 114.719 -173.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 43.5 t 47.18 45.88 16.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.923 1.689 . . . . 0.0 112.69 -170.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 157.33 21.82 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.876 1.27 . . . . 0.0 111.656 167.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -63.87 -34.22 77.45 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.659 1.184 . . . . 0.0 113.993 -171.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 9.7 ptmm? -163.04 158.9 22.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.069 1.748 . . . . 0.0 111.77 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -134.02 122.33 22.86 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.638 1.175 . . . . 0.0 110.105 173.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -88.16 92.73 9.26 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.149 0.579 . . . . 0.0 110.047 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -78.66 126.05 30.2 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.884 -0.51 . . . . 0.0 111.253 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -99.12 115.57 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.833 1.253 . . . . 0.0 108.091 171.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -88.68 87.37 7.23 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.904 -0.497 . . . . 0.0 110.005 167.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.8 t -151.39 171.07 18.07 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.267 1.027 . . . . 0.0 112.998 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.6 mtp-105 -74.64 163.62 67.01 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 126.376 1.871 . . . . 0.0 110.934 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.84 -24.08 25.13 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.24 1.96 . . . . 0.0 114.393 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.54 -57.12 27.08 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.92 1.288 . . . . 0.0 112.95 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.37 -1.06 8.36 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.194 2.596 . . . . 0.0 114.602 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -99.72 -54.62 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 126.291 1.836 . . . . 0.0 109.665 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -44.96 77.61 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.41 -0.806 . . . . 0.0 112.843 -178.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.76 -4.11 38.64 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -172.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.4 mt -53.72 -35.56 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.702 0.801 . . . . 0.0 110.654 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.69 157.84 19.29 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.842 1.257 . . . . 0.0 113.196 172.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -155.45 109.26 2.83 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.985 1.714 . . . . 0.0 110.373 177.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.05 2.41 88.25 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.57 1.081 . . . . 0.0 114.909 -178.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.9 mt -76.23 118.92 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.752 1.221 . . . . 0.0 111.223 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -113.27 -9.7 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 126.887 2.075 . . . . 0.0 110.863 173.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.4 7.72 3.34 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.517 2.327 . . . . 0.0 116.01 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 79.4 p 50.24 61.8 3.01 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.711 1.605 . . . . 0.0 113.909 -173.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -156.14 155.99 33.47 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.576 1.551 . . . . 0.0 110.952 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -138.65 -171.81 3.15 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.959 -1.088 . . . . 0.0 111.106 166.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.4 t -124.87 142.34 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.294 1.437 . . . . 0.0 108.583 173.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.1 tp -47.97 137.4 10.19 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.241 1.016 . . . . 0.0 111.99 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.88 171.95 1.93 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.618 0.767 . . . . 0.0 112.293 175.041 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.6 t -118.27 -25.61 6.54 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.401 1.081 . . . . 0.0 113.835 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.1 m -82.4 169.81 16.01 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.655 1.182 . . . . 0.0 111.989 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -116.76 103.56 10.47 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.281 1.032 . . . . 0.0 111.4 -175.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -98.33 162.12 13.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.75 1.62 . . . . 0.0 110.96 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.64 105.81 4.41 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.918 -0.489 . . . . 0.0 110.122 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -97.93 124.62 42.45 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.615 1.166 . . . . 0.0 111.642 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.1 t -125.62 95.08 4.32 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 125.647 1.579 . . . . 0.0 110.05 -172.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.97 138.65 31.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.961 1.304 . . . . 0.0 110.506 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 43.3 m -113.32 151.4 31.24 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.95 -1.094 . . . . 0.0 108.481 161.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -135.57 123.65 22.91 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.811 0.844 . . . . 0.0 109.391 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.1 t -57.05 146.23 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.648 0.779 . . . . 0.0 111.483 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -135.65 103.63 5.5 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.235 1.014 . . . . 0.0 111.666 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.253 1.285 0 C-N-CA 126.693 1.997 . . . . 0.0 111.426 179.671 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.2 -48.52 0.35 Allowed 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.105 1.87 . . . . 0.0 113.305 -165.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.4 m -136.92 -167.89 2.17 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.692 2.397 . . . . 0.0 109.352 175.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.12 146.97 43.76 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.565 1.146 . . . . 0.0 109.327 168.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -141.51 161.31 38.22 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.456 1.502 . . . . 0.0 110.423 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -105.42 158.04 16.93 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.031 1.332 . . . . 0.0 113.766 177.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.72 110.9 18.17 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.701 2.0 . . . . 0.0 111.466 -171.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -134.98 98.43 4.01 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.086 1.354 . . . . 0.0 112.234 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -116.5 137.27 52.3 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.398 1.479 . . . . 0.0 111.171 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 72.9 m -145.94 167.44 23.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.141 1.776 . . . . 0.0 111.027 -175.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 m -140.3 104.53 4.81 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.289 -0.882 . . . . 0.0 111.24 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -171.86 171.82 5.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.937 1.295 . . . . 0.0 113.252 -170.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.458 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -62.98 172.73 1.62 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 128.788 2.835 . . . . 0.0 113.658 168.94 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -143.46 145.33 32.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.569 1.948 . . . . 0.0 111.643 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.3 t -105.36 139.33 40.16 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.023 0.929 . . . . 0.0 111.277 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.523 HG23 HD22 ' A' ' 104' ' ' ASN . 15.9 m -146.88 -178.93 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.306 1.842 . . . . 0.0 111.335 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.2 m -127.03 116.02 20.09 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.688 1.195 . . . . 0.0 111.552 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -85.45 131.57 34.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.345 0.658 . . . . 0.0 111.616 173.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.84 115.45 10.62 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.22 1.408 . . . . 0.0 108.55 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.5 m120 58.6 54.98 5.05 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.958 1.303 . . . . 0.0 112.335 -170.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 65.03 25.54 12.63 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.493 2.317 . . . . 0.0 115.077 169.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.6 133.08 5.73 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.962 1.305 . . . . 0.0 109.653 -175.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -75.91 108.55 2.71 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.803 3.002 . . . . 0.0 112.984 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.483 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.8 m -111.01 15.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 126.169 1.788 . . . . 0.0 113.044 -178.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.4 143.67 24.07 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.139 1.336 . . . . 0.0 111.086 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -102.39 126.78 49.52 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.677 1.191 . . . . 0.0 111.407 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.6 t -101.68 -56.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.903 0.881 . . . . 0.0 111.852 -178.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.27 -171.78 41.15 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 -170.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 t -131.26 120.39 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.005 1.722 . . . . 0.0 110.168 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.27 2.29 25.34 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.579 0.992 . . . . 0.0 115.579 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.4 p -170.28 166.86 8.68 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.895 2.478 . . . . 0.0 111.079 -176.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.8 m -107.47 110.56 22.53 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.539 1.536 . . . . 0.0 110.996 173.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.11 78.2 1.69 Allowed Glycine 0 CA--C 1.534 1.223 0 C-N-CA 125.332 1.444 . . . . 0.0 113.245 -177.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 6.6 t -82.21 174.58 11.05 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.617 1.167 . . . . 0.0 113.197 177.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 177.76 -179.27 48.37 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 126.303 1.906 . . . . 0.0 113.38 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -134.13 60.03 0.66 Allowed Glycine 0 CA--C 1.533 1.185 0 C-N-CA 125.544 1.545 . . . . 0.0 113.378 -175.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.8 m -137.19 161.45 36.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.694 1.597 . . . . 0.0 112.107 -178.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.38 25.69 3.2 Favored Glycine 0 CA--C 1.539 1.531 0 C-N-CA 125.916 1.722 . . . . 0.0 115.684 -175.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 68.4 mt -65.5 139.51 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 125.83 1.652 . . . . 0.0 110.815 -175.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -150.81 8.95 0.58 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.156 1.383 . . . . 0.0 113.629 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 pp -62.71 -27.96 69.62 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.378 1.471 . . . . 0.0 114.747 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -59.6 162.81 4.72 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.884 2.074 . . . . 0.0 113.481 171.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.1 m -58.8 -31.04 68.07 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 121.079 -1.013 . . . . 0.0 112.799 178.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.4 t 47.82 59.36 4.24 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.93 2.092 . . . . 0.0 113.303 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.7 mp -59.78 -14.18 13.54 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -173.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.8 p -62.14 -28.47 69.67 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.568 1.547 . . . . 0.0 114.143 171.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.55 104.61 8.81 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.535 1.534 . . . . 0.0 111.627 175.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 103.19 -2.5 47.28 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.449 1.5 . . . . 0.0 115.255 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.1 m -136.4 -166.07 1.83 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.016 1.326 . . . . 0.0 111.435 175.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -153.22 170.61 20.14 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.752 2.021 . . . . 0.0 109.279 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.483 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.0 t-105 -54.19 -36.97 63.99 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.585 1.554 . . . . 0.0 112.293 166.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -44.41 92.02 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.901 0.881 . . . . 0.0 111.491 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.6 p -84.97 -26.05 27.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.297 1.039 . . . . 0.0 113.771 176.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -52.47 -42.3 64.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.785 1.634 . . . . 0.0 112.996 173.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -57.62 -62.54 1.72 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.056 0.942 . . . . 0.0 110.475 172.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.22 -22.13 50.73 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -67.65 -55.23 14.09 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.186 1.795 . . . . 0.0 112.44 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -146.52 22.27 1.31 Allowed 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -173.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -126.78 147.84 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 O-C-N 120.473 -1.392 . . . . 0.0 109.006 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.8 t -143.05 152.08 41.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -83.27 -1.5 53.32 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.838 1.655 . . . . 0.0 112.779 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.9 t -163.26 107.48 1.05 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.204 1.802 . . . . 0.0 111.429 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -67.92 110.54 3.91 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.376 -1.453 . . . . 0.0 110.42 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -129.33 7.71 5.42 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.603 1.561 . . . . 0.0 113.088 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.5 t -75.68 141.35 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.804 1.241 . . . . 0.0 111.983 -172.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -126.3 4.99 7.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.075 1.75 . . . . 0.0 113.437 -178.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.0 m 55.07 40.12 31.8 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 126.957 2.103 . . . . 0.0 114.26 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -152.16 -26.23 0.18 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.084 2.154 . . . . 0.0 113.432 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -99.61 -5.24 29.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.63 1.172 . . . . 0.0 113.482 176.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -64.53 -5.07 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.939 1.296 . . . . 0.0 114.435 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -53.5 -25.93 18.66 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 160.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.3 t -97.54 -15.84 20.35 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.708 1.603 . . . . 0.0 113.844 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 49.3 p -94.75 -179.81 4.99 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.014 1.326 . . . . 0.0 110.94 175.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -68.43 -11.19 59.35 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -85.52 12.54 8.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.548 2.339 . . . . 0.0 114.811 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 36.5 p90 -67.21 -8.77 34.06 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.061 2.144 . . . . 0.0 114.76 -171.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -62.59 -6.64 3.67 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.445 2.298 . . . . 0.0 115.384 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.0 t 40.55 56.02 2.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.513 1.925 . . . . 0.0 112.949 -165.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 158.87 28.17 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.223 1.409 . . . . 0.0 111.61 167.344 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.82 -35.48 80.8 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -172.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -160.4 156.53 26.27 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.097 1.759 . . . . 0.0 111.564 170.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -131.34 129.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.775 1.23 . . . . 0.0 109.61 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.0 m -96.83 93.84 6.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.691 0.796 . . . . 0.0 109.68 177.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -77.89 127.86 33.04 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.529 0.732 . . . . 0.0 111.394 175.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.6 mt -105.77 114.2 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.985 1.714 . . . . 0.0 107.901 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -86.35 84.2 7.51 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.822 -0.549 . . . . 0.0 110.479 170.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.8 m -141.88 158.29 43.97 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.611 1.565 . . . . 0.0 112.665 178.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -72.41 161.48 78.86 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.898 1.279 . . . . 0.0 110.762 164.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.8 -21.58 28.47 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.401 2.067 . . . . 0.0 114.375 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -61.5 -58.11 20.7 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 119.551 1.069 . . . . 0.0 112.572 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.37 0.41 5.39 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.148 2.565 . . . . 0.0 115.039 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -103.61 -54.96 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.336 1.854 . . . . 0.0 109.747 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -44.47 78.88 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.112 -0.993 . . . . 0.0 112.884 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.11 32.98 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.509 1.299 . . . . 0.0 114.509 -173.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.2 mt -52.61 -35.95 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.622 0.769 . . . . 0.0 110.645 169.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.8 p -109.8 159.99 16.72 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.286 1.034 . . . . 0.0 113.277 174.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 tptp -155.11 107.2 2.68 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.694 1.598 . . . . 0.0 110.567 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 6.29 88.67 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.275 0.941 . . . . 0.0 114.898 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.1 mt -76.56 115.39 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.518 1.159 . . . . 0.0 110.952 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 mt -112.33 -10.59 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 126.833 2.053 . . . . 0.0 110.893 173.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.96 3.79 6.32 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.406 2.282 . . . . 0.0 115.72 -173.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.1 t 53.44 66.2 1.3 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.819 1.647 . . . . 0.0 113.013 -173.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -156.46 160.53 39.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.281 1.832 . . . . 0.0 111.298 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.523 HD22 HG23 ' A' ' 16' ' ' VAL . 5.7 t-20 -142.31 -169.73 3.02 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.693 -1.254 . . . . 0.0 111.733 164.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.5 t -125.08 139.68 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.652 1.581 . . . . 0.0 108.783 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.9 tp -49.53 139.71 11.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.743 1.217 . . . . 0.0 111.836 170.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.1 172.28 1.47 Allowed 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 174.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.1 t -122.49 -30.36 3.94 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.93 1.292 . . . . 0.0 113.802 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.5 m -75.63 169.89 17.23 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.546 1.138 . . . . 0.0 111.648 171.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -123.7 105.03 9.36 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.991 0.916 . . . . 0.0 111.524 -173.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -100.28 163.76 12.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.622 1.969 . . . . 0.0 110.835 -171.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -73.86 104.16 4.64 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.724 -0.61 . . . . 0.0 110.411 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.07 131.0 44.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.089 1.355 . . . . 0.0 111.892 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.6 t -135.84 96.8 3.49 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.156 1.382 . . . . 0.0 110.801 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -93.6 155.03 17.52 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.706 0.765 . . . . 0.0 111.77 171.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.08 99.24 3.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.594 0.757 . . . . 0.0 110.979 171.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -86.59 133.05 33.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.74 1.216 . . . . 0.0 111.2 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.98 147.79 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 C-N-CA 125.075 1.35 . . . . 0.0 111.933 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 76.5 p -120.89 96.21 5.02 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.065 1.346 . . . . 0.0 111.536 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.456 1.502 . . . . 0.0 112.762 176.479 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 61.8 mtt85 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 118.964 -0.541 . . . . 0.0 109.95 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -72.66 -52.05 0.17 Allowed 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 121.863 1.708 . . . . 0.0 112.881 -169.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.0 m -141.63 168.33 20.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.157 2.183 . . . . 0.0 110.064 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -87.97 137.55 32.23 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.767 1.227 . . . . 0.0 109.997 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -137.17 160.86 37.77 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.694 1.198 . . . . 0.0 112.29 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -96.15 155.31 16.81 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.635 2.374 . . . . 0.0 111.447 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tp -80.34 127.89 32.92 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.674 1.19 . . . . 0.0 111.352 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -147.33 96.86 2.77 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.335 1.454 . . . . 0.0 112.006 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 mmtm -100.55 149.12 24.05 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.193 1.397 . . . . 0.0 111.208 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 29.6 m -155.89 169.0 25.44 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.203 1.801 . . . . 0.0 111.152 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 m -141.17 105.27 4.79 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.293 -0.88 . . . . 0.0 110.867 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 20.7 p30 -170.28 172.09 6.39 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.778 1.231 . . . . 0.0 113.652 -171.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.78 174.24 0.63 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 128.241 2.616 . . . . 0.0 114.515 168.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.79 143.77 31.5 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.878 2.071 . . . . 0.0 111.702 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 t -102.99 140.23 37.52 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.569 1.148 . . . . 0.0 111.095 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.527 HG23 HD22 ' A' ' 104' ' ' ASN . 15.8 m -147.18 -179.94 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 125.926 1.69 . . . . 0.0 111.711 -175.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 m -125.56 117.78 24.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.828 1.251 . . . . 0.0 111.583 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.81 131.52 34.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.625 0.77 . . . . 0.0 111.517 173.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -135.21 115.93 13.89 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.69 1.596 . . . . 0.0 108.437 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.5 m120 56.47 55.82 6.2 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.688 1.195 . . . . 0.0 112.416 -171.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.59 24.83 11.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.551 2.34 . . . . 0.0 114.936 169.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -155.54 131.26 5.51 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.485 1.114 . . . . 0.0 109.567 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -76.29 102.32 1.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.975 3.116 . . . . 0.0 112.046 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.404 HG12 ' H ' ' A' ' 51' ' ' TRP . 14.7 m -90.44 -10.21 10.23 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.583 0 CA-C-O 117.728 -1.129 . . . . 0.0 112.494 -179.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -138.58 133.3 32.33 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.657 1.571 . . . . 0.0 111.041 -163.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -82.93 144.81 29.77 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.288 0.495 . . . . 0.0 110.168 171.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -116.31 -51.78 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.831 0.853 . . . . 0.0 111.652 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.81 -177.23 47.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 123.564 0.602 . . . . 0.0 113.018 -176.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -124.56 133.3 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.522 1.129 . . . . 0.0 111.494 -174.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.7 -6.58 6.11 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.551 1.072 . . . . 0.0 115.616 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -173.6 169.04 4.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.538 3.135 . . . . 0.0 109.201 -168.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.6 m -103.61 132.18 50.09 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.592 1.557 . . . . 0.0 110.683 173.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.5 84.93 0.74 Allowed Glycine 0 CA--C 1.532 1.142 0 C-N-CA 126.049 1.785 . . . . 0.0 113.056 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.4 t -61.84 164.23 6.6 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.976 1.31 . . . . 0.0 113.01 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 77.19 -42.89 1.94 Allowed Glycine 0 CA--C 1.538 1.523 0 C-N-CA 126.128 1.823 . . . . 0.0 114.859 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.28 88.44 1.99 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.759 1.647 . . . . 0.0 112.695 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.8 m -56.71 134.9 55.16 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.527 1.531 . . . . 0.0 112.962 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -77.84 35.96 1.65 Allowed Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.038 1.78 . . . . 0.0 115.707 -174.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 66.2 mt -69.29 140.39 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 125.783 1.633 . . . . 0.0 109.969 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -135.58 -2.41 2.44 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.341 1.456 . . . . 0.0 114.246 -177.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.85 -21.02 63.39 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.233 1.413 . . . . 0.0 112.78 -177.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -139.69 161.51 37.37 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.676 1.991 . . . . 0.0 111.798 173.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.9 m -74.17 -19.99 60.36 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.783 1.233 . . . . 0.0 111.957 168.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.4 t 54.5 30.4 12.9 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.399 1.88 . . . . 0.0 113.713 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.2 mp 55.13 75.31 0.32 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.499 2.32 . . . . 0.0 112.336 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.9 t -116.62 -39.2 3.35 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.108 1.763 . . . . 0.0 113.714 -176.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.87 134.94 37.41 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.486 1.514 . . . . 0.0 111.072 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 66.93 11.86 58.93 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 124.583 1.087 . . . . 0.0 115.586 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 39.6 p -104.58 -179.67 4.01 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.495 1.918 . . . . 0.0 111.832 -178.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -153.76 156.53 37.91 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 122.554 1.169 . . . . 0.0 111.889 176.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.404 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.6 t-105 -50.27 -37.25 35.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.044 1.738 . . . . 0.0 111.813 162.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -27.21 64.48 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.471 1.508 . . . . 0.0 113.019 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.2 p -106.78 -20.5 13.32 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.837 1.655 . . . . 0.0 113.942 174.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -51.3 -40.97 60.14 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.136 1.774 . . . . 0.0 112.557 171.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -58.13 -65.21 0.68 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.779 1.232 . . . . 0.0 110.519 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.01 -21.76 63.9 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -177.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -63.14 -48.04 80.17 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.1 1.76 . . . . 0.0 113.674 174.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -154.39 21.25 0.48 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 115.759 1.762 . . . . 0.0 115.759 -175.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.5 mt -128.47 147.3 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.354 1.461 . . . . 0.0 109.386 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -144.71 154.48 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 176.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -86.63 0.44 54.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.076 1.75 . . . . 0.0 112.591 167.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.67 109.88 1.27 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.443 1.897 . . . . 0.0 111.279 176.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 ttp85 -66.96 104.49 1.39 Allowed 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.473 -1.392 . . . . 0.0 110.304 171.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -114.79 5.7 15.31 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.833 1.653 . . . . 0.0 112.677 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 85.7 t -81.73 139.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.241 1.016 . . . . 0.0 111.454 -173.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -126.37 8.07 7.11 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.201 1.8 . . . . 0.0 112.539 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 28.3 m 53.33 40.9 32.0 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.27 2.228 . . . . 0.0 113.487 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -153.16 -26.44 0.15 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 127.818 2.447 . . . . 0.0 112.851 178.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -99.43 -5.11 30.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.746 1.218 . . . . 0.0 113.808 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -63.98 -8.24 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.837 1.255 . . . . 0.0 114.136 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.2 tmm? -55.71 -31.01 62.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.152 0.981 . . . . 0.0 112.677 163.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.5 m -88.98 -9.16 52.44 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.572 1.549 . . . . 0.0 114.671 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.4 p -106.14 179.15 4.35 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.261 1.425 . . . . 0.0 111.218 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -65.61 -15.59 62.89 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.551 -1.343 . . . . 0.0 114.097 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.9 7.52 8.7 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 127.42 2.288 . . . . 0.0 114.694 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -63.79 -8.06 9.62 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.126 2.171 . . . . 0.0 115.093 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 58.7 t60 -61.29 -10.74 7.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.217 1.807 . . . . 0.0 114.796 -174.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.1 t 39.55 62.45 1.18 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.968 2.107 . . . . 0.0 113.249 -165.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 159.97 32.02 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.741 161.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.54 -31.32 72.32 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.36 1.464 . . . . 0.0 114.625 -171.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.6 ptmm? -160.4 156.49 26.22 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.576 1.55 . . . . 0.0 111.541 168.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -128.22 149.28 50.53 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.857 0.863 . . . . 0.0 110.231 168.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.9 m -115.33 91.8 3.72 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.049 0.94 . . . . 0.0 109.769 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -80.25 128.12 33.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.278 0.561 . . . . 0.0 111.266 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 82.6 mt -105.93 113.69 43.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.001 1.721 . . . . 0.0 107.432 176.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -84.24 89.08 7.27 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.676 -0.64 . . . . 0.0 110.022 168.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 64.3 p -149.07 164.49 34.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.511 1.124 . . . . 0.0 112.811 171.446 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -76.45 161.77 73.39 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.701 1.2 . . . . 0.0 110.611 171.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -68.99 -21.35 37.2 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.028 1.819 . . . . 0.0 114.563 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.95 -57.38 21.67 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 119.483 1.038 . . . . 0.0 113.015 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.2 -0.46 5.69 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.446 2.764 . . . . 0.0 115.157 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -101.41 -56.42 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 109.577 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.04 -43.76 86.62 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.229 -0.919 . . . . 0.0 113.031 -179.166 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.93 -3.28 34.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 64.5 mt -53.5 -35.8 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.529 0.732 . . . . 0.0 110.615 170.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.0 p -109.02 159.26 16.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.284 1.034 . . . . 0.0 113.262 174.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -153.91 102.07 2.48 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.845 1.658 . . . . 0.0 110.577 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.85 5.47 87.91 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.175 0.893 . . . . 0.0 114.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.8 mt -73.82 115.68 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-N 118.635 1.217 . . . . 0.0 111.177 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -109.42 -12.1 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 126.614 1.966 . . . . 0.0 110.809 171.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.15 5.68 4.18 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.477 2.311 . . . . 0.0 116.217 -170.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.0 t 52.38 64.87 1.69 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.446 1.498 . . . . 0.0 112.741 -173.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -156.13 158.05 37.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 126.279 1.832 . . . . 0.0 111.058 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.527 HD22 HG23 ' A' ' 16' ' ' VAL . 6.0 t-20 -144.34 -169.59 3.17 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.747 -1.22 . . . . 0.0 111.839 163.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.84 141.37 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 125.681 1.592 . . . . 0.0 108.735 171.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.2 tp -50.73 141.6 12.69 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.682 1.193 . . . . 0.0 111.889 170.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.58 171.49 1.98 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 173.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -122.4 -20.46 6.09 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.804 1.242 . . . . 0.0 114.017 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 41.1 m -83.96 170.37 14.06 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.07 1.348 . . . . 0.0 111.63 174.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -117.57 106.02 12.68 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.576 1.151 . . . . 0.0 111.023 -178.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -98.93 159.2 15.12 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.714 1.606 . . . . 0.0 110.341 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -70.52 106.94 3.63 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.944 -0.472 . . . . 0.0 110.232 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.48 132.31 44.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.952 1.301 . . . . 0.0 111.789 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.4 t -136.11 93.57 2.93 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.746 1.219 . . . . 0.0 109.87 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.8 159.28 17.82 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.733 0.813 . . . . 0.0 110.488 171.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.07 139.79 29.13 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.257 1.023 . . . . 0.0 109.371 161.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -124.13 125.94 45.34 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.545 1.138 . . . . 0.0 110.573 -174.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.07 145.34 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.561 0.744 . . . . 0.0 111.634 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.2 t -135.9 105.69 6.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.471 1.108 . . . . 0.0 111.453 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.6 t . . . . . 0 C--O 1.254 1.33 0 C-N-CA 126.539 1.936 . . . . 0.0 111.56 -179.402 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 119.296 -0.383 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -81.13 -46.4 0.08 OUTLIER 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 121.994 1.796 . . . . 0.0 114.126 -164.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 m -135.18 165.97 24.18 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.804 2.042 . . . . 0.0 109.817 171.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.549 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.6 mmpt? -95.34 142.74 27.37 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.942 0.897 . . . . 0.0 110.983 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -136.91 156.14 48.85 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.509 1.524 . . . . 0.0 110.995 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.97 151.64 19.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.17 1.388 . . . . 0.0 112.302 172.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.6 110.31 16.85 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.743 2.017 . . . . 0.0 111.372 -174.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -130.36 116.97 19.04 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.544 1.537 . . . . 0.0 111.466 175.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -130.35 150.43 51.59 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.968 1.707 . . . . 0.0 110.835 174.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.8 m -156.69 173.9 16.27 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.198 1.799 . . . . 0.0 111.43 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -144.27 101.49 3.71 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.067 -1.021 . . . . 0.0 110.861 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 20.8 p-10 -166.13 175.8 8.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.192 1.397 . . . . 0.0 113.108 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.417 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -65.21 170.02 5.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.162 2.585 . . . . 0.0 113.276 172.545 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -140.37 143.76 35.89 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.736 1.614 . . . . 0.0 111.811 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.7 t -102.21 143.99 31.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.916 0.865 . . . . 0.0 111.232 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -147.5 -178.05 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.455 1.902 . . . . 0.0 111.597 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.3 m -126.91 115.4 19.22 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.768 1.227 . . . . 0.0 111.612 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.9 t -83.29 129.87 35.03 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.113 0.965 . . . . 0.0 111.497 176.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.11 113.0 8.13 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.51 1.124 . . . . 0.0 108.538 177.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.7 59.46 3.22 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.522 1.529 . . . . 0.0 113.025 -169.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 62.84 26.46 15.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.599 2.359 . . . . 0.0 114.8 169.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.43 134.7 5.8 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 125.317 1.447 . . . . 0.0 109.559 -176.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.41 107.97 2.6 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.644 2.896 . . . . 0.0 113.072 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.446 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.9 m -108.31 17.58 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.777 2.031 . . . . 0.0 112.603 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -153.27 140.53 19.52 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.137 1.335 . . . . 0.0 110.589 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -86.07 148.2 25.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.928 0.491 . . . . 0.0 110.387 170.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.4 t -119.0 -58.8 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 123.675 0.79 . . . . 0.0 111.771 173.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.86 -172.3 42.18 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-N 118.537 0.608 . . . . 0.0 114.089 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.2 t -128.77 123.99 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.179 1.392 . . . . 0.0 109.891 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.3 3.49 25.2 Favored Glycine 0 CA--C 1.541 1.713 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -175.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 99.0 p -165.87 164.89 18.55 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.15 2.18 . . . . 0.0 111.42 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 93.1 m -112.72 108.64 17.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.631 1.572 . . . . 0.0 110.611 171.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -90.12 164.36 30.96 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 123.971 0.796 . . . . 0.0 112.617 171.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.1 t -154.18 179.93 8.5 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.959 1.304 . . . . 0.0 111.721 174.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -151.69 172.22 31.12 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.624 1.583 . . . . 0.0 113.475 177.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -129.96 21.04 5.01 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 125.828 1.68 . . . . 0.0 114.808 -175.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.5 m -125.35 164.85 19.49 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.97 1.708 . . . . 0.0 112.423 -173.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.2 21.99 2.12 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 126.017 1.77 . . . . 0.0 115.864 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 90.7 mt -65.0 147.69 12.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 126.59 1.956 . . . . 0.0 110.52 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -140.62 14.53 2.34 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 125.081 1.352 . . . . 0.0 113.346 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.56 -15.35 63.51 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -176.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.68 169.87 3.7 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.212 1.005 . . . . 0.0 113.388 169.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 36.3 m -70.17 -20.54 63.12 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.917 -1.115 . . . . 0.0 113.147 176.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.3 p 46.1 43.07 10.51 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.115 2.166 . . . . 0.0 115.007 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mp -55.03 -20.8 10.22 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.62 1.568 . . . . 0.0 114.299 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.0 p -55.34 -33.15 63.11 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.333 1.853 . . . . 0.0 114.692 173.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.09 104.1 8.67 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.624 1.57 . . . . 0.0 111.362 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.21 -0.19 50.8 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.441 1.496 . . . . 0.0 115.193 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -137.09 -165.87 1.82 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.284 1.433 . . . . 0.0 111.032 173.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -155.12 171.94 18.96 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.903 1.681 . . . . 0.0 109.558 -178.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.446 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.2 t-105 -55.07 -36.64 65.83 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.142 1.777 . . . . 0.0 112.185 169.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.88 -37.34 76.35 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.866 1.266 . . . . 0.0 112.195 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 p -89.47 -27.91 20.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.542 1.137 . . . . 0.0 113.521 174.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -52.05 -44.4 64.25 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.787 1.635 . . . . 0.0 113.067 174.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -56.02 -63.06 1.3 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -60.36 -20.01 57.83 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -70.11 -46.87 63.9 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.123 1.369 . . . . 0.0 113.311 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -153.04 23.65 0.56 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -176.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.4 mt -128.62 147.8 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 120.147 -1.596 . . . . 0.0 109.299 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -147.78 155.68 41.94 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 177.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.07 2.31 54.27 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.255 1.822 . . . . 0.0 112.814 167.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.1 t -160.18 114.41 2.22 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.185 1.794 . . . . 0.0 111.23 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.9 ttp-105 -66.47 103.21 1.0 Allowed 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.669 -1.27 . . . . 0.0 110.45 172.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -112.83 2.89 16.12 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.059 1.344 . . . . 0.0 113.45 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.419 HG22 ' H ' ' A' ' 67' ' ' CYS . 8.2 p -75.54 145.06 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.355 1.062 . . . . 0.0 112.398 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -130.32 8.08 5.03 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.112 1.765 . . . . 0.0 112.703 172.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.419 ' H ' HG22 ' A' ' 65' ' ' VAL . 21.4 m 48.37 50.85 16.04 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.895 2.478 . . . . 0.0 113.238 -176.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.43 -17.01 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.366 2.266 . . . . 0.0 113.202 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -110.26 -2.99 16.49 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.936 1.695 . . . . 0.0 113.767 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -63.98 -8.66 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.637 1.575 . . . . 0.0 113.913 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 ppp? -53.01 -22.51 5.83 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.8 t -98.07 -21.26 16.88 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.487 1.515 . . . . 0.0 113.995 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.1 p -87.35 -177.7 6.01 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 111.849 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -63.22 -20.53 65.51 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.832 -1.168 . . . . 0.0 113.646 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.79 21.81 3.39 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.569 1.948 . . . . 0.0 113.326 -175.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -63.6 -7.03 6.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 126.092 1.757 . . . . 0.0 114.663 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 66.0 t60 -64.7 -6.46 7.92 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.583 1.553 . . . . 0.0 114.653 -177.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.31 33.6 18.72 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.187 1.795 . . . . 0.0 114.476 -177.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 158.18 3.52 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.061 1.745 . . . . 0.0 113.926 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.04 -35.69 81.07 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.435 1.494 . . . . 0.0 114.877 -173.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -161.18 163.44 31.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.185 1.394 . . . . 0.0 112.774 165.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -131.63 166.18 22.02 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.979 0.912 . . . . 0.0 111.336 166.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.0 m -126.73 93.84 3.89 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.734 1.214 . . . . 0.0 109.404 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -77.95 122.64 25.78 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.259 0.624 . . . . 0.0 110.759 174.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -98.64 114.52 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.954 1.302 . . . . 0.0 107.848 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -87.02 86.1 7.29 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.386 0.612 . . . . 0.0 110.122 167.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.5 p -145.87 166.66 25.31 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.897 1.279 . . . . 0.0 112.205 168.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -73.29 164.47 60.73 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.406 1.082 . . . . 0.0 111.325 168.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.91 -23.19 25.83 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.747 2.298 . . . . 0.0 114.521 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -59.57 -58.49 19.09 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.61 1.164 . . . . 0.0 112.806 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.56 0.73 5.08 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.307 2.671 . . . . 0.0 114.926 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.6 t -103.3 -55.57 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 126.604 1.962 . . . . 0.0 109.82 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -43.07 85.11 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.208 -0.933 . . . . 0.0 112.769 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.64 -5.58 46.18 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -173.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.5 mt -53.49 -36.01 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.598 0.759 . . . . 0.0 110.58 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 p -111.5 158.44 19.16 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.805 1.242 . . . . 0.0 113.057 173.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -155.77 105.97 2.44 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.742 1.617 . . . . 0.0 110.579 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.35 5.62 86.94 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 123.984 0.802 . . . . 0.0 114.733 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.4 mt -77.45 116.53 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.676 1.19 . . . . 0.0 110.87 -178.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 7.5 mt -111.33 -12.52 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 126.768 2.027 . . . . 0.0 110.879 175.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.32 7.67 2.68 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 127.633 2.373 . . . . 0.0 116.095 -170.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.9 t 49.69 66.11 1.22 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.996 1.318 . . . . 0.0 113.276 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.1 tttt -159.37 157.46 30.39 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.352 1.461 . . . . 0.0 111.356 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -145.01 -169.11 3.11 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.576 -1.327 . . . . 0.0 112.067 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 16.8 t -125.74 143.2 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 126.127 1.771 . . . . 0.0 108.865 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.5 tp -50.78 141.91 12.32 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.559 1.143 . . . . 0.0 111.982 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.94 172.9 1.53 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 8.8 t -120.37 -28.85 4.93 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.799 1.24 . . . . 0.0 113.573 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.9 m -76.96 171.7 14.37 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.419 1.488 . . . . 0.0 111.845 173.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -123.04 110.4 15.29 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.118 0.967 . . . . 0.0 111.144 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -105.98 159.67 15.87 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.157 1.783 . . . . 0.0 110.245 -171.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.64 109.54 4.38 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.337 0.589 . . . . 0.0 110.513 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.03 123.18 44.81 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.283 1.433 . . . . 0.0 111.231 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.9 t -126.71 93.61 3.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.436 1.494 . . . . 0.0 110.686 -173.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.02 163.45 16.28 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.463 0.649 . . . . 0.0 110.329 173.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.96 138.77 19.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 158.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -126.74 134.6 50.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.931 1.292 . . . . 0.0 109.271 -175.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 29.2 t -60.9 149.93 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 123.556 0.742 . . . . 0.0 111.816 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -134.52 106.64 7.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.22 1.408 . . . . 0.0 110.933 171.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.253 1.262 0 C-N-CA 126.244 1.818 . . . . 0.0 112.602 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.0 ptt180 . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.95 -50.04 0.22 Allowed 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 121.612 1.541 . . . . 0.0 111.521 172.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -145.84 179.28 7.57 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.61 2.364 . . . . 0.0 109.574 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -110.16 131.16 55.31 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.644 1.178 . . . . 0.0 110.733 -177.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.84 161.94 33.79 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.222 1.409 . . . . 0.0 111.924 -176.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -107.55 151.13 26.01 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.002 1.721 . . . . 0.0 112.764 177.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.74 113.36 16.75 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.555 1.942 . . . . 0.0 111.487 -172.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -139.55 109.45 6.36 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.39 1.476 . . . . 0.0 111.883 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -118.12 153.81 33.17 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.417 1.487 . . . . 0.0 111.637 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.0 m -156.21 172.19 18.89 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.17 1.788 . . . . 0.0 111.557 175.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 m -141.26 104.91 4.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.869 0.868 . . . . 0.0 110.569 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.6 p30 -169.42 172.43 7.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.682 1.193 . . . . 0.0 113.664 -170.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.79 174.28 0.85 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.271 2.628 . . . . 0.0 114.397 167.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.01 147.06 32.21 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.682 1.993 . . . . 0.0 111.726 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 t -108.37 134.94 50.48 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.869 1.268 . . . . 0.0 111.404 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.3 m -141.79 -178.68 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.935 1.694 . . . . 0.0 111.707 -173.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.431 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.1 m -129.86 115.04 16.66 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.457 -0.777 . . . . 0.0 111.785 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.3 t -83.0 128.54 34.57 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.53 1.132 . . . . 0.0 111.254 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.23 112.16 8.42 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.682 1.193 . . . . 0.0 108.45 177.428 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 56.05 60.52 3.18 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.61 1.564 . . . . 0.0 112.968 -169.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.46 27.06 15.08 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.719 2.408 . . . . 0.0 114.751 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.17 133.8 5.45 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 109.519 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -75.86 105.12 2.02 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.809 3.006 . . . . 0.0 112.137 177.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 m -97.84 14.33 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.834 1.254 . . . . 0.0 111.997 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.431 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 24.7 t-80 -158.42 147.73 19.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.328 1.422 . . . . 0.0 113.025 -167.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -108.77 128.0 54.5 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.007 1.323 . . . . 0.0 111.009 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.4 t -93.66 -58.24 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.027 0.931 . . . . 0.0 110.97 174.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.77 -175.58 46.62 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.448 1.023 . . . . 0.0 112.652 -172.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.9 p -122.79 136.86 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.43 1.092 . . . . 0.0 111.84 -172.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.96 -5.36 3.67 Favored Glycine 0 CA--C 1.541 1.714 0 N-CA-C 116.2 1.24 . . . . 0.0 116.2 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -172.5 165.46 5.65 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 129.929 3.292 . . . . 0.0 109.527 -171.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 83.9 m -101.8 112.22 24.75 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.042 1.337 . . . . 0.0 110.427 173.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.27 80.59 0.27 Allowed Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.6 1.571 . . . . 0.0 112.924 -174.042 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.4 t -89.99 173.97 7.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.546 1.139 . . . . 0.0 113.415 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.05 149.5 8.37 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 127.562 2.505 . . . . 0.0 113.678 176.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 151.79 165.09 12.72 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 125.724 1.631 . . . . 0.0 113.686 176.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.6 m -143.52 90.71 2.18 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.384 1.474 . . . . 0.0 111.521 -172.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.65 5.01 67.37 Favored Glycine 0 CA--C 1.541 1.715 0 C-N-CA 124.521 1.058 . . . . 0.0 115.101 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 90.4 mt -72.26 144.32 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 126.499 1.92 . . . . 0.0 110.095 -178.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -137.64 15.01 2.93 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.33 1.452 . . . . 0.0 114.049 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.1 mp -61.52 -20.99 63.83 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.038 1.735 . . . . 0.0 114.313 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.18 167.15 6.9 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.199 1.4 . . . . 0.0 113.458 170.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.4 m -73.78 -20.67 60.41 Favored 'General case' 0 N--CA 1.479 0.975 0 O-C-N 120.724 -1.235 . . . . 0.0 113.473 176.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 95.4 p 48.09 36.62 6.72 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 127.447 2.299 . . . . 0.0 116.044 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -48.85 -28.12 3.52 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 126.257 1.823 . . . . 0.0 114.452 177.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.9 t -57.72 -21.72 42.4 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.191 1.396 . . . . 0.0 114.347 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.17 107.84 10.75 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.468 1.507 . . . . 0.0 111.056 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.11 1.21 61.3 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.055 1.312 . . . . 0.0 115.375 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -137.66 -165.09 1.72 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.456 1.502 . . . . 0.0 111.438 174.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -154.02 173.61 15.78 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.394 1.478 . . . . 0.0 110.845 -175.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -56.78 -36.99 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.186 2.194 . . . . 0.0 112.215 167.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.47 90.4 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.699 1.2 . . . . 0.0 111.587 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.6 p -82.93 -29.3 29.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.099 1.36 . . . . 0.0 113.532 174.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.56 -43.87 65.5 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.389 1.476 . . . . 0.0 112.699 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.12 -61.58 2.36 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.12 0.968 . . . . 0.0 110.536 173.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.66 -19.86 52.27 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -178.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -70.32 -48.44 56.52 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.764 1.626 . . . . 0.0 112.986 175.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -152.34 22.85 0.63 Allowed 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.8 mt -128.08 144.16 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 120.439 -1.413 . . . . 0.0 109.534 178.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.4 t -143.36 156.39 44.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 178.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -91.42 0.83 57.46 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.396 1.878 . . . . 0.0 112.487 167.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.3 t -162.8 112.29 1.38 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.338 1.855 . . . . 0.0 111.185 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.8 ttp-105 -68.0 107.34 2.65 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.545 -1.347 . . . . 0.0 110.673 173.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.47 1.57 13.68 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.142 1.377 . . . . 0.0 113.687 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.0 p -69.92 142.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.07 1.348 . . . . 0.0 112.516 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -130.96 12.16 5.17 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.268 1.827 . . . . 0.0 112.424 169.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.9 m 51.48 40.93 27.9 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.034 2.534 . . . . 0.0 113.152 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -153.25 -38.68 0.1 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.379 2.271 . . . . 0.0 111.362 -174.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -90.97 -8.3 49.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.369 1.067 . . . . 0.0 113.493 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.0 pt -62.15 -10.59 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.347 1.059 . . . . 0.0 113.721 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.83 -36.04 35.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.82 1.648 . . . . 0.0 113.451 166.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 96.0 p -87.3 -14.5 40.68 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 177.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.6 p -86.17 -178.84 6.61 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.221 1.408 . . . . 0.0 111.869 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -70.88 -12.43 61.54 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -85.93 10.02 15.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.031 2.132 . . . . 0.0 114.989 -176.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -67.49 -7.49 26.07 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 127.978 2.511 . . . . 0.0 114.605 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -61.79 0.54 0.35 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.237 2.615 . . . . 0.0 115.846 -174.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.6 t 56.15 30.96 17.38 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.233 1.813 . . . . 0.0 114.2 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.57 154.85 27.63 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.973 1.309 . . . . 0.0 112.616 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -63.96 -33.72 76.36 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.922 1.289 . . . . 0.0 114.322 -169.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.3 pttm -162.01 163.79 28.66 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.559 1.544 . . . . 0.0 111.901 166.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -132.94 159.31 40.34 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.574 0.749 . . . . 0.0 110.674 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.0 m -122.73 90.41 3.29 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.363 1.065 . . . . 0.0 110.332 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -77.42 119.93 21.72 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.638 0.775 . . . . 0.0 111.134 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.6 mt -96.08 112.92 29.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 125.645 1.578 . . . . 0.0 107.65 173.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -80.5 89.61 5.64 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.532 -0.73 . . . . 0.0 109.783 167.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.0 m -149.0 159.2 44.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.56 1.144 . . . . 0.0 112.981 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 25.8 mtt-85 -71.14 163.79 62.55 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 124.575 1.15 . . . . 0.0 111.115 164.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.59 -24.2 30.69 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 122.301 2.0 . . . . 0.0 114.201 176.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.61 -56.37 30.35 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 117.921 -1.038 . . . . 0.0 113.091 -175.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.79 -0.39 6.87 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.983 2.455 . . . . 0.0 114.826 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -102.9 -54.44 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.323 1.849 . . . . 0.0 109.749 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -45.53 78.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.209 -0.932 . . . . 0.0 112.848 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.56 35.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -172.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.09 -35.68 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 123.642 0.777 . . . . 0.0 110.599 169.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.3 p -111.07 157.42 20.0 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.864 1.266 . . . . 0.0 113.217 172.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -155.37 106.25 2.54 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.583 1.953 . . . . 0.0 109.875 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.6 3.24 86.49 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.39 0.995 . . . . 0.0 114.754 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.2 mt -76.12 116.05 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.706 1.202 . . . . 0.0 110.86 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 17.9 mt -105.54 -18.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 126.447 1.899 . . . . 0.0 110.807 173.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.12 8.87 1.12 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 128.095 2.558 . . . . 0.0 116.909 -166.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 8.7 t 50.7 62.08 2.89 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.895 1.225 . . . . 0.0 113.48 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -157.55 154.62 28.87 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 125.919 1.687 . . . . 0.0 111.242 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -138.09 -170.54 2.82 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.869 -1.145 . . . . 0.0 111.534 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.85 141.92 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 125.75 1.62 . . . . 0.0 108.524 173.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.6 tp -51.01 140.96 14.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.29 1.036 . . . . 0.0 111.72 169.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.58 170.85 2.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 122.583 1.183 . . . . 0.0 113.508 172.193 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.8 p -118.26 -30.89 5.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.567 1.947 . . . . 0.0 113.353 -176.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.5 m -80.52 171.08 15.5 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.711 1.604 . . . . 0.0 112.086 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -118.48 110.09 17.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.796 1.238 . . . . 0.0 111.164 -176.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -104.75 161.08 14.47 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.809 1.644 . . . . 0.0 110.374 -173.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -71.47 109.14 5.25 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.876 -0.515 . . . . 0.0 110.417 -179.538 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -101.28 126.62 48.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.668 1.187 . . . . 0.0 112.003 -176.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 30.1 t -128.76 91.48 3.23 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.326 1.45 . . . . 0.0 109.855 -174.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -82.21 161.85 22.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.851 0.834 . . . . 0.0 110.407 169.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.58 128.73 11.15 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.04 -1.037 . . . . 0.0 109.484 157.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -116.96 136.87 52.61 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.406 1.083 . . . . 0.0 110.114 -173.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 20.6 t -60.5 147.35 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-O 121.451 0.643 . . . . 0.0 112.043 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.8 t -137.64 101.8 4.58 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.049 1.34 . . . . 0.0 111.269 172.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.0 p . . . . . 0 C--O 1.254 1.305 0 C-N-CA 126.591 1.956 . . . . 0.0 114.403 178.93 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 119.285 -0.388 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -74.73 -51.22 0.13 Allowed 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.44 2.093 . . . . 0.0 113.522 -168.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.68 -167.34 2.11 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.752 2.421 . . . . 0.0 109.217 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.12 149.41 42.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.736 1.214 . . . . 0.0 109.845 167.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -142.73 159.08 42.93 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.888 1.675 . . . . 0.0 110.213 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -99.11 157.21 16.51 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.481 1.112 . . . . 0.0 113.061 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.95 103.35 14.59 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.367 1.467 . . . . 0.0 111.093 -169.307 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -127.98 114.72 17.49 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.457 1.503 . . . . 0.0 111.118 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -130.86 147.67 52.54 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.05 1.74 . . . . 0.0 110.865 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.6 t -151.11 170.3 19.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.842 1.657 . . . . 0.0 110.987 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.4 m -139.7 100.86 4.06 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.479 -0.763 . . . . 0.0 110.768 173.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.93 176.74 9.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.833 1.253 . . . . 0.0 113.519 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.25 170.3 3.87 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.471 2.308 . . . . 0.0 113.608 171.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.9 p90 -141.15 142.18 34.08 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.122 1.769 . . . . 0.0 111.541 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.5 t -100.52 142.71 31.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.801 0.81 . . . . 0.0 111.413 174.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.483 HG23 HD22 ' A' ' 104' ' ' ASN . 16.8 m -147.24 -178.3 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 126.564 1.945 . . . . 0.0 110.983 -178.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -126.49 117.37 22.74 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.93 1.292 . . . . 0.0 111.532 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -87.1 133.0 33.66 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.658 0.783 . . . . 0.0 111.704 174.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -139.89 113.63 8.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.261 1.425 . . . . 0.0 108.501 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 59.47 56.7 3.6 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.402 1.481 . . . . 0.0 112.416 -169.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.12 24.81 13.57 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.629 2.372 . . . . 0.0 115.1 169.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.1 132.7 5.32 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.855 1.262 . . . . 0.0 109.639 -174.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.45 109.05 2.79 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.565 2.843 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.453 HG12 ' N ' ' A' ' 51' ' ' TRP . 4.0 m -108.52 18.2 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.692 1.997 . . . . 0.0 112.518 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -156.51 137.31 13.37 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.659 -1.276 . . . . 0.0 110.826 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -80.69 153.82 27.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.056 0.389 . . . . 0.0 110.452 167.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.9 -54.54 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.216 1.006 . . . . 0.0 112.155 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.45 -172.28 43.43 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.259 0.936 . . . . 0.0 114.677 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -125.91 129.04 72.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 125.413 1.485 . . . . 0.0 109.99 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.17 -4.58 4.56 Favored Glycine 0 CA--C 1.539 1.565 0 N-CA-C 116.664 1.426 . . . . 0.0 116.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.0 m -162.43 162.96 27.88 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.558 3.143 . . . . 0.0 109.869 -172.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 90.2 m -106.6 120.19 41.29 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.212 1.405 . . . . 0.0 109.771 167.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.44 145.56 50.0 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 123.358 0.504 . . . . 0.0 112.233 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.5 t -145.35 159.77 42.55 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.072 1.349 . . . . 0.0 111.476 178.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 154.16 -173.27 32.75 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.475 1.512 . . . . 0.0 113.253 -174.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -142.78 88.85 0.18 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 125.487 1.517 . . . . 0.0 112.137 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 91.6 p -136.13 169.85 16.96 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.716 1.606 . . . . 0.0 112.946 -178.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -104.39 16.41 48.85 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.853 1.692 . . . . 0.0 115.062 -175.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 73.0 mt -62.83 137.13 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.458 1.503 . . . . 0.0 110.748 -174.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 30.9 p90 -135.68 5.94 3.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.087 1.755 . . . . 0.0 113.675 -175.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.57 -16.12 61.26 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.64 1.576 . . . . 0.0 112.612 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -67.64 163.64 20.93 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.068 1.347 . . . . 0.0 113.093 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 33.3 m -66.65 -33.75 76.35 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.012 0.925 . . . . 0.0 111.824 175.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.8 t 34.27 71.61 0.1 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 128.631 2.772 . . . . 0.0 114.036 -172.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.2 mp -57.79 -10.63 1.76 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.87 1.668 . . . . 0.0 115.111 -178.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.2 p -57.76 -38.88 76.18 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.035 1.334 . . . . 0.0 114.138 171.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -117.33 107.13 14.01 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.073 1.749 . . . . 0.0 110.951 -178.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.96 2.58 62.51 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 124.954 1.264 . . . . 0.0 115.264 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.21 -166.99 2.08 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.986 1.393 . . . . 0.0 111.482 173.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -153.98 173.38 16.06 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.563 1.545 . . . . 0.0 110.348 -178.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.453 ' N ' HG12 ' A' ' 24' ' ' VAL . 1.6 t-105 -56.67 -36.57 69.74 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.481 1.912 . . . . 0.0 112.357 168.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -45.08 89.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.034 1.334 . . . . 0.0 111.413 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.2 p -80.43 -30.94 37.64 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.854 1.262 . . . . 0.0 113.427 173.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -53.49 -44.14 68.79 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.318 1.447 . . . . 0.0 113.131 177.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -53.45 -61.58 2.21 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.147 0.979 . . . . 0.0 110.421 172.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -59.29 -20.06 51.29 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -72.66 -52.7 14.25 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.155 1.782 . . . . 0.0 113.856 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -133.14 7.88 3.99 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -175.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.4 mt -127.5 147.5 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 120.541 -1.349 . . . . 0.0 110.108 -172.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 12.5 t -143.34 154.99 44.31 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 174.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -91.18 0.52 57.51 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.194 1.798 . . . . 0.0 112.359 168.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.45 114.3 2.14 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.196 1.799 . . . . 0.0 111.192 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -67.93 103.39 1.47 Allowed 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.563 -1.336 . . . . 0.0 110.506 172.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -113.56 4.85 16.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.447 1.499 . . . . 0.0 113.046 177.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.6 t -79.74 142.55 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.434 1.093 . . . . 0.0 111.47 -176.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -128.71 9.66 5.95 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.032 1.733 . . . . 0.0 112.504 175.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 15.8 m 52.49 44.34 30.08 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.52 2.328 . . . . 0.0 113.043 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.7 -25.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.992 2.117 . . . . 0.0 113.245 -177.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -101.05 -5.05 26.28 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.751 1.22 . . . . 0.0 113.717 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.3 pt -61.41 -11.96 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.89 1.276 . . . . 0.0 114.005 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -57.37 -28.9 63.58 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.832 0.853 . . . . 0.0 112.923 167.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 t -83.82 1.26 43.92 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.01 1.724 . . . . 0.0 114.234 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.0 p -117.4 -177.02 3.13 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.611 1.565 . . . . 0.0 111.882 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -63.48 -17.85 63.16 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.14 -0.975 . . . . 0.0 113.539 171.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.77 11.71 25.99 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.204 1.802 . . . . 0.0 114.199 -170.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -63.3 -8.84 9.49 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.789 2.435 . . . . 0.0 115.313 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -62.28 -10.11 9.96 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.082 1.753 . . . . 0.0 114.759 -173.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 46.1 t 39.66 59.01 1.93 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.994 2.117 . . . . 0.0 113.234 -166.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.88 161.13 27.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.888 1.275 . . . . 0.0 111.743 162.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.88 -34.06 77.1 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.198 1.399 . . . . 0.0 114.381 -172.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.9 ptmt -160.02 157.05 28.02 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.7 1.6 . . . . 0.0 111.889 167.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -121.44 152.89 38.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.551 0.74 . . . . 0.0 109.42 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.5 m -112.36 98.13 7.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.017 1.327 . . . . 0.0 108.035 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -82.05 136.33 35.23 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.593 -0.692 . . . . 0.0 111.873 176.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.5 mt -109.12 109.7 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 125.942 1.697 . . . . 0.0 107.029 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.34 89.23 6.56 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.536 -0.727 . . . . 0.0 109.456 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 m -149.52 160.21 43.66 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.972 1.309 . . . . 0.0 112.687 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -70.16 163.42 61.86 Favored Pre-proline 0 N--CA 1.47 0.546 0 C-N-CA 124.326 1.05 . . . . 0.0 111.187 164.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.35 -23.55 27.97 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.312 2.008 . . . . 0.0 114.229 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.27 -57.7 23.92 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.088 -177.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.74 0.62 5.36 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.062 2.508 . . . . 0.0 114.855 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.27 -54.65 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.522 1.929 . . . . 0.0 109.748 176.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -46.01 76.29 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.129 -0.982 . . . . 0.0 112.745 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.44 -3.08 31.81 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -172.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.5 mt -53.19 -36.39 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 123.558 0.743 . . . . 0.0 110.403 168.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -107.96 159.0 16.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.084 0.954 . . . . 0.0 113.409 174.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.95 106.69 2.87 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.438 1.895 . . . . 0.0 109.779 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.53 5.08 90.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 124.301 0.953 . . . . 0.0 114.987 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.6 mt -75.85 116.11 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.646 1.179 . . . . 0.0 111.226 -176.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -110.82 -10.94 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 126.577 1.951 . . . . 0.0 111.008 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.14 3.76 5.22 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.447 2.299 . . . . 0.0 116.061 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 52.98 64.46 1.85 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.695 1.598 . . . . 0.0 112.717 -172.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -155.79 158.81 38.75 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.816 2.046 . . . . 0.0 110.968 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.483 HD22 HG23 ' A' ' 16' ' ' VAL . 6.9 t-20 -141.51 -167.56 2.45 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.715 -1.241 . . . . 0.0 111.469 163.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -124.51 145.7 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.331 1.452 . . . . 0.0 109.488 167.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -51.94 142.3 15.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.69 1.196 . . . . 0.0 111.944 168.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.22 172.77 2.28 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.7 t -122.66 -25.07 4.76 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.098 1.359 . . . . 0.0 113.931 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.3 m -80.52 170.93 15.69 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.76 1.224 . . . . 0.0 111.993 172.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -117.54 110.96 18.6 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.726 1.21 . . . . 0.0 111.348 -177.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -106.39 161.98 14.09 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.87 1.668 . . . . 0.0 110.603 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -71.57 108.01 4.73 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 121.745 -0.597 . . . . 0.0 110.297 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -99.89 119.21 37.85 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.594 1.558 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.1 t -122.43 97.33 5.41 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.038 1.335 . . . . 0.0 110.459 -171.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -93.52 163.03 13.73 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.512 0.725 . . . . 0.0 111.067 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.82 107.85 3.22 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.496 -0.753 . . . . 0.0 111.875 163.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -92.58 132.41 36.88 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.606 1.163 . . . . 0.0 111.215 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.0 t -56.72 148.07 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.509 1.523 . . . . 0.0 112.008 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.1 p -118.11 86.88 2.61 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.905 1.282 . . . . 0.0 111.684 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 32.2 p . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.833 1.653 . . . . 0.0 114.151 173.459 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 38.3 ptt85 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.749 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.73 -59.99 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 121.512 1.475 . . . . 0.0 112.027 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 m -140.89 175.78 9.34 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.357 1.863 . . . . 0.0 110.417 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -97.42 130.07 44.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.522 1.129 . . . . 0.0 110.516 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -134.33 160.63 37.34 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.9 1.28 . . . . 0.0 112.205 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -109.57 153.14 24.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.536 1.934 . . . . 0.0 112.443 177.059 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.52 112.83 19.79 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.319 1.848 . . . . 0.0 111.727 -170.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -139.56 103.29 4.66 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.455 . . . . 0.0 112.275 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -124.32 149.82 46.15 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.316 1.046 . . . . 0.0 111.656 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.1 t -148.79 174.81 11.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.603 1.561 . . . . 0.0 111.9 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.1 m -140.45 102.87 4.43 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.032 0.933 . . . . 0.0 110.997 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -168.66 170.22 9.6 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.916 1.286 . . . . 0.0 113.45 -172.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.426 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -60.07 170.85 1.11 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.911 2.484 . . . . 0.0 113.617 168.551 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.22 147.65 35.19 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.369 1.868 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 t -106.1 141.91 36.68 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.063 0.945 . . . . 0.0 111.607 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.7 m -145.75 -179.4 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.175 1.79 . . . . 0.0 111.876 -175.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.3 m -127.17 118.55 24.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.144 0.978 . . . . 0.0 111.954 176.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.8 t -87.36 127.73 35.2 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.204 1.002 . . . . 0.0 111.794 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -135.58 114.72 12.3 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.057 1.343 . . . . 0.0 109.107 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.6 m120 57.25 57.04 4.72 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 112.535 -172.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 64.33 26.66 13.67 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.468 2.307 . . . . 0.0 114.719 170.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.41 135.08 6.56 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.961 1.304 . . . . 0.0 109.548 -177.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.56 107.85 2.57 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.714 2.943 . . . . 0.0 112.564 177.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.9 m -100.76 6.46 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.495 1.518 . . . . 0.0 112.236 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -148.53 146.62 28.4 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.797 1.635 . . . . 0.0 112.592 -175.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -103.0 131.7 49.79 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.732 1.213 . . . . 0.0 111.108 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -104.52 -52.96 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.146 0.978 . . . . 0.0 112.084 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.62 -172.58 44.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 119.098 0.863 . . . . 0.0 114.924 -173.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.8 t -123.69 124.01 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.724 1.61 . . . . 0.0 110.354 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 65.78 3.62 16.41 Favored Glycine 0 CA--C 1.54 1.594 0 N-CA-C 115.864 1.105 . . . . 0.0 115.864 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.5 m -169.88 163.75 9.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 128.62 2.768 . . . . 0.0 110.382 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -103.98 105.86 16.18 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.574 1.55 . . . . 0.0 110.532 172.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.7 71.1 0.21 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 125.51 1.528 . . . . 0.0 113.166 -173.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -68.51 161.97 26.68 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.106 0.962 . . . . 0.0 112.395 173.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 164.49 -179.25 39.36 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.242 1.401 . . . . 0.0 113.805 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -126.17 106.2 0.84 Allowed Glycine 0 CA--C 1.532 1.104 0 C-N-CA 126.107 1.813 . . . . 0.0 111.774 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.6 t -140.01 171.45 14.17 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.234 1.414 . . . . 0.0 112.138 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -90.8 6.96 81.87 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.099 1.809 . . . . 0.0 115.37 -176.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 66.7 mt -60.0 136.05 24.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.797 1.639 . . . . 0.0 111.553 -174.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -142.22 18.42 2.08 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 126.575 1.95 . . . . 0.0 112.555 177.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.6 mt -70.89 -17.11 62.72 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.999 1.32 . . . . 0.0 114.443 -170.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -120.24 174.93 6.21 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.016 1.727 . . . . 0.0 112.586 167.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.6 m -57.03 -23.87 49.59 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.397 1.879 . . . . 0.0 113.435 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.5 t 42.91 68.37 0.51 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 128.091 2.556 . . . . 0.0 112.648 179.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 45' ' ' LEU . 3.7 mp -51.39 106.09 0.13 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.873 2.069 . . . . 0.0 111.015 -176.46 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.2 t -155.44 -64.62 0.12 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.56 1.144 . . . . 0.0 111.382 -173.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.97 115.78 31.07 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.506 1.523 . . . . 0.0 110.619 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 74.89 10.35 83.69 Favored Glycine 0 CA--C 1.539 1.568 0 C-N-CA 124.175 0.893 . . . . 0.0 115.242 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 51.4 m -109.08 172.53 6.79 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.475 1.51 . . . . 0.0 111.34 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -155.66 168.52 26.91 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 123.429 1.585 . . . . 0.0 113.092 -177.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -57.18 -33.7 67.72 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.181 2.192 . . . . 0.0 113.787 174.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.96 -46.13 89.19 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.097 -1.002 . . . . 0.0 110.62 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.2 p -76.9 -26.53 54.24 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 173.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -52.81 -46.01 67.51 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.57 1.548 . . . . 0.0 112.46 175.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -56.96 -60.66 3.25 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.072 0.949 . . . . 0.0 110.791 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.99 -24.94 60.22 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.37 -54.58 22.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.649 1.58 . . . . 0.0 114.047 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -146.9 20.22 1.27 Allowed 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.3 mt -126.72 150.19 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.063 1.345 . . . . 0.0 109.701 173.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 t -141.68 151.9 43.42 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -84.03 -3.71 58.22 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.604 1.562 . . . . 0.0 112.909 170.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.0 t -162.26 118.26 1.97 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.255 1.822 . . . . 0.0 110.991 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.9 ttp-105 -69.0 100.31 1.2 Allowed 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.515 -1.365 . . . . 0.0 111.389 174.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -107.52 4.18 25.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.568 1.547 . . . . 0.0 113.171 173.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.5 t -75.45 138.72 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.327 1.451 . . . . 0.0 111.426 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -126.68 4.56 6.74 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.794 1.638 . . . . 0.0 113.155 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.6 m 54.16 35.78 23.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.98 2.112 . . . . 0.0 113.321 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -153.52 -27.38 0.14 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.742 2.417 . . . . 0.0 112.513 -172.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -115.06 3.88 14.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.146 1.778 . . . . 0.0 114.27 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.9 pt -63.57 -8.33 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.219 1.407 . . . . 0.0 113.617 174.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.9 ttt -54.1 -28.15 37.55 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.955 1.302 . . . . 0.0 112.752 162.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 t -92.98 -0.7 57.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.153 1.781 . . . . 0.0 114.215 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.8 p -114.76 -175.59 2.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.385 1.474 . . . . 0.0 111.4 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -64.15 -15.91 60.78 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 120.935 -1.103 . . . . 0.0 113.711 176.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -100.28 17.72 20.66 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.167 1.787 . . . . 0.0 114.24 -164.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -68.85 -7.64 36.31 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 128.984 2.914 . . . . 0.0 114.682 -173.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -63.28 2.26 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 128.179 2.592 . . . . 0.0 115.817 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.2 t 56.79 27.92 13.57 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.263 1.825 . . . . 0.0 114.117 -176.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 154.93 17.68 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.131 1.372 . . . . 0.0 112.207 177.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.7 -33.97 77.21 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.9 ptmm? -161.37 160.03 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.905 1.682 . . . . 0.0 112.676 167.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -131.03 125.37 33.09 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.377 1.071 . . . . 0.0 109.766 163.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -87.64 95.2 9.97 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.546 1.138 . . . . 0.0 109.964 171.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -82.5 127.83 33.7 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.878 -0.514 . . . . 0.0 111.455 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 61.8 mt -97.93 114.92 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 125.015 1.326 . . . . 0.0 107.845 172.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.26 87.45 7.14 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.46 0.704 . . . . 0.0 110.203 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.2 m -144.94 165.63 27.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.739 2.015 . . . . 0.0 112.549 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -74.22 164.28 62.35 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 124.339 1.056 . . . . 0.0 110.761 161.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.28 -23.98 17.2 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.509 2.139 . . . . 0.0 114.147 174.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.21 -55.59 44.73 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 124.419 1.088 . . . . 0.0 113.466 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.46 -1.51 9.18 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 123.107 2.538 . . . . 0.0 114.575 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.55 -54.24 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 126.249 1.819 . . . . 0.0 109.398 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -45.33 81.22 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.25 -0.906 . . . . 0.0 112.912 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.85 -3.63 36.28 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -171.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 52.8 mt -53.93 -35.34 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 123.609 0.764 . . . . 0.0 110.665 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 21.0 p -111.39 158.43 19.08 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.245 1.418 . . . . 0.0 113.118 173.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -155.56 112.99 3.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.978 1.711 . . . . 0.0 110.402 175.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.09 2.95 90.57 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.666 1.127 . . . . 0.0 114.97 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 50.6 mt -77.33 118.53 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.967 1.307 . . . . 0.0 111.063 -176.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.0 mt -111.15 -13.1 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.595 1.958 . . . . 0.0 111.046 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.2 1.96 6.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.389 2.276 . . . . 0.0 116.355 -168.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.66 68.47 0.82 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.594 1.558 . . . . 0.0 112.431 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -158.06 149.36 21.22 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.361 1.864 . . . . 0.0 110.516 -176.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -140.4 -168.1 2.48 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.643 -1.286 . . . . 0.0 111.364 164.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -126.36 149.38 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 125.636 1.575 . . . . 0.0 109.729 168.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.4 tp -53.47 142.39 22.28 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.75 1.22 . . . . 0.0 111.644 168.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.52 173.24 1.7 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 173.22 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.6 t -124.9 -23.38 4.29 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.755 1.222 . . . . 0.0 114.177 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.9 m -79.59 170.52 16.43 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.38 1.072 . . . . 0.0 111.498 169.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -124.73 104.94 8.93 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.139 0.976 . . . . 0.0 111.522 -173.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -101.65 163.11 12.43 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.058 2.143 . . . . 0.0 110.798 -171.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -75.6 105.89 6.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.597 -0.689 . . . . 0.0 110.669 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.81 119.47 35.34 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.834 1.253 . . . . 0.0 111.667 178.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.8 t -119.64 87.63 2.78 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 126.041 1.736 . . . . 0.0 110.001 -171.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.9 163.94 21.9 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.325 1.06 . . . . 0.0 111.318 168.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -154.99 124.45 6.41 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.67 1.588 . . . . 0.0 108.689 162.511 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -111.04 139.39 46.44 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.357 1.063 . . . . 0.0 109.909 -175.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 16.0 t -60.99 148.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.754 0.822 . . . . 0.0 111.89 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.2 t -140.48 86.05 2.04 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-O 122.694 1.235 . . . . 0.0 111.867 173.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.255 1.389 0 C-N-CA 125.745 1.618 . . . . 0.0 111.993 174.664 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.26 -51.1 0.12 Allowed 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 122.496 2.13 . . . . 0.0 113.165 -164.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -141.11 167.49 22.06 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.701 2.4 . . . . 0.0 109.204 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.543 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.3 mmpt? -93.43 143.86 25.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.533 0.733 . . . . 0.0 111.174 172.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -138.25 161.64 36.36 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.557 1.543 . . . . 0.0 111.473 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -97.43 154.23 17.61 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 127.297 2.239 . . . . 0.0 110.863 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.2 tp -79.83 128.47 33.48 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.964 0.906 . . . . 0.0 111.062 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.9 tptt -148.66 97.08 2.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.519 1.528 . . . . 0.0 111.771 173.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -110.72 142.52 42.53 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.819 1.247 . . . . 0.0 110.931 175.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 38.7 m -153.42 172.69 16.71 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.971 1.708 . . . . 0.0 111.066 -176.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 m -145.44 101.57 3.6 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.969 -1.082 . . . . 0.0 110.885 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.28 175.12 8.51 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.034 1.333 . . . . 0.0 113.316 -176.27 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.12 170.7 3.44 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 128.215 2.606 . . . . 0.0 113.801 171.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -140.06 142.56 36.15 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.116 1.767 . . . . 0.0 111.802 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -101.62 141.82 33.91 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.855 0.862 . . . . 0.0 111.405 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.516 HG23 HD22 ' A' ' 104' ' ' ASN . 15.2 m -146.75 -178.95 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 126.32 1.848 . . . . 0.0 111.282 -175.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.2 m -125.68 117.92 24.53 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.436 1.094 . . . . 0.0 111.194 174.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -84.4 134.57 34.47 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.564 0.697 . . . . 0.0 111.336 172.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.75 114.62 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.421 1.489 . . . . 0.0 108.403 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.7 m120 57.98 55.78 5.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.668 1.187 . . . . 0.0 112.504 -171.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.9 24.43 11.23 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 127.655 2.382 . . . . 0.0 115.189 169.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.16 133.41 6.14 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 124.914 1.285 . . . . 0.0 109.421 -176.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.04 103.39 1.73 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.71 2.94 . . . . 0.0 112.354 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 m -98.41 10.08 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.178 1.391 . . . . 0.0 112.288 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -150.62 143.66 24.75 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.851 1.659 . . . . 0.0 112.295 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -98.2 137.12 37.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.217 1.007 . . . . 0.0 111.29 174.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -110.86 -53.77 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.97 0.908 . . . . 0.0 111.754 178.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.38 -171.12 42.91 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-N 118.782 0.719 . . . . 0.0 114.227 -174.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.14 129.45 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 0.0 109.799 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.16 0.21 7.19 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -168.58 164.27 12.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.577 2.351 . . . . 0.0 110.645 -174.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.5 m -110.35 113.61 26.41 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.994 1.718 . . . . 0.0 111.419 173.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.12 104.84 1.88 Allowed Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.941 1.258 . . . . 0.0 112.345 175.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.9 t -60.12 148.98 34.02 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.43 1.092 . . . . 0.0 113.129 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.18 -88.39 0.12 Allowed Glycine 0 CA--C 1.536 1.381 0 C-N-CA 125.972 1.749 . . . . 0.0 112.618 -175.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -178.58 163.67 31.7 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 126.402 1.953 . . . . 0.0 111.949 172.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 97.5 p -74.0 167.27 21.85 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.99 -0.712 . . . . 0.0 112.305 173.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.74 -17.14 80.04 Favored Glycine 0 CA--C 1.537 1.456 0 O-C-N 121.529 -0.732 . . . . 0.0 114.094 174.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.7 mp -82.21 135.24 25.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 C-N-CA 125.549 1.539 . . . . 0.0 110.261 177.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -135.46 14.13 3.47 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.558 1.543 . . . . 0.0 113.237 177.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 87.8 mt -64.71 -20.79 66.53 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.171 1.788 . . . . 0.0 113.93 -177.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -109.97 158.21 18.47 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.376 1.47 . . . . 0.0 111.594 168.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.7 m -71.38 -27.16 63.14 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.469 0.708 . . . . 0.0 112.2 175.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 7.3 t 57.89 16.24 3.53 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.447 1.899 . . . . 0.0 114.385 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.1 mp 56.27 97.36 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.313 3.045 . . . . 0.0 111.884 -171.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.2 t -138.4 -61.22 0.6 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.251 1.02 . . . . 0.0 112.624 -170.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -116.49 123.04 46.47 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.464 1.506 . . . . 0.0 110.54 178.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.44 7.18 72.52 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 124.36 0.981 . . . . 0.0 115.287 -177.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 50.2 m -101.37 171.87 7.33 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.209 1.404 . . . . 0.0 111.554 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -154.44 167.51 29.78 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 123.107 1.432 . . . . 0.0 112.94 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -59.44 -34.05 72.03 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.436 1.895 . . . . 0.0 113.715 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.09 -44.73 96.04 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.982 -1.073 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 p -76.18 -28.02 57.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.05 1.34 . . . . 0.0 113.965 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -52.44 -45.19 65.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.65 1.568 . . . . 0.0 112.749 176.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.58 -62.81 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.447 1.099 . . . . 0.0 110.629 173.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -60.55 -19.78 58.37 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.67 -51.15 44.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.176 1.79 . . . . 0.0 113.769 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -151.24 23.4 0.73 Allowed 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -174.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -127.99 148.9 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 125.493 1.517 . . . . 0.0 109.367 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -146.74 156.95 43.55 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -92.74 2.7 56.6 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.227 1.811 . . . . 0.0 112.403 169.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.03 114.06 2.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.216 1.806 . . . . 0.0 111.089 172.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.6 ttp-105 -66.58 106.33 1.76 Allowed 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.675 -1.266 . . . . 0.0 110.643 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -116.05 4.16 13.68 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.353 1.461 . . . . 0.0 113.346 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.3 p -75.91 145.69 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.392 1.077 . . . . 0.0 112.978 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -130.88 6.85 4.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.24 1.816 . . . . 0.0 112.943 173.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 m 50.78 47.7 24.08 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 127.589 2.355 . . . . 0.0 113.53 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.12 -28.23 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.651 2.38 . . . . 0.0 112.323 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 25.3 p30 -103.65 0.44 30.7 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.183 1.393 . . . . 0.0 113.563 179.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.7 pt -62.81 -11.53 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.095 1.358 . . . . 0.0 113.706 177.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -54.67 -31.3 57.5 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.238 1.015 . . . . 0.0 112.899 165.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.1 m -82.39 1.71 35.95 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.219 1.408 . . . . 0.0 114.527 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.7 p -118.0 -176.12 2.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.895 1.678 . . . . 0.0 111.715 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -64.86 -19.12 65.72 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.21 13.08 12.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.364 1.866 . . . . 0.0 114.208 -172.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -66.31 -9.74 35.95 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.032 2.133 . . . . 0.0 114.82 -172.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -7.75 3.78 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.625 2.37 . . . . 0.0 115.554 -173.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.0 t 39.11 58.69 1.8 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 126.793 2.037 . . . . 0.0 113.635 -168.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.403 ' HG3' ' H ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER -68.91 160.98 29.72 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.136 1.374 . . . . 0.0 112.025 162.445 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.84 -31.27 71.77 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -170.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -160.12 156.23 26.42 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.402 1.481 . . . . 0.0 111.959 169.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -132.1 112.68 12.53 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.115 0.966 . . . . 0.0 111.032 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.8 m -83.43 96.71 8.64 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.442 0.697 . . . . 0.0 110.439 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -80.64 132.87 35.65 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 122.835 0.454 . . . . 0.0 111.233 173.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 78.1 mt -104.95 113.54 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.196 1.398 . . . . 0.0 107.661 171.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -85.6 86.43 7.37 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.313 0.578 . . . . 0.0 109.614 167.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -150.39 167.42 27.14 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.95 1.3 . . . . 0.0 112.518 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -79.85 160.68 68.53 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 126.059 1.744 . . . . 0.0 110.536 175.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -70.54 -22.84 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.076 1.851 . . . . 0.0 114.593 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.32 -57.14 21.7 Favored Pre-proline 0 N--CA 1.473 0.721 0 C-N-CA 124.214 1.006 . . . . 0.0 112.977 -178.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.04 -0.27 5.34 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.212 2.608 . . . . 0.0 114.897 178.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.6 t -101.33 -54.9 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.584 1.953 . . . . 0.0 109.736 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -45.78 78.55 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.288 -0.883 . . . . 0.0 112.924 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.53 -2.96 31.46 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.4 mt -53.41 -35.87 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.618 0.767 . . . . 0.0 110.486 169.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.1 p -109.56 158.93 17.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.415 1.086 . . . . 0.0 113.222 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -155.57 103.27 2.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.114 1.766 . . . . 0.0 109.899 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.93 4.57 84.51 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.389 0.995 . . . . 0.0 114.807 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.2 mt -74.93 114.76 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.599 1.2 . . . . 0.0 111.113 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.93 -15.13 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 126.717 2.007 . . . . 0.0 110.68 171.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.54 23.92 0.21 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.666 2.787 . . . . 0.0 115.45 -171.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.2 p 41.28 64.63 0.97 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.334 1.854 . . . . 0.0 114.069 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.6 158.7 40.13 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.709 1.603 . . . . 0.0 111.215 -177.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.516 HD22 HG23 ' A' ' 16' ' ' VAL . 5.7 t-20 -142.34 -170.63 3.22 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.738 -1.226 . . . . 0.0 111.796 160.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -124.09 139.58 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.541 1.537 . . . . 0.0 108.705 171.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.85 140.17 12.22 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.551 1.14 . . . . 0.0 111.906 170.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.4 172.28 1.59 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.1 t -119.55 -29.65 5.04 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.969 1.308 . . . . 0.0 113.366 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.7 m -77.14 169.58 18.08 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.305 1.442 . . . . 0.0 112.171 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -117.83 107.39 14.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.442 1.097 . . . . 0.0 111.22 -177.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -100.55 161.81 13.35 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.729 1.612 . . . . 0.0 110.595 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -72.1 106.38 4.32 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.285 0.564 . . . . 0.0 110.294 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -97.63 122.19 40.42 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.498 1.519 . . . . 0.0 110.889 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 37.8 t -126.14 93.63 3.87 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.512 1.525 . . . . 0.0 109.312 -173.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -93.69 163.09 13.68 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.286 1.041 . . . . 0.0 111.057 172.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -148.51 134.8 19.44 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.54 1.536 . . . . 0.0 108.429 164.153 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.3 m-80 -118.27 127.94 54.2 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.512 1.125 . . . . 0.0 110.391 -175.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.27 144.85 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.657 0.783 . . . . 0.0 111.874 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -135.31 103.51 5.53 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.919 1.287 . . . . 0.0 111.197 173.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.255 1.351 0 C-N-CA 126.238 1.815 . . . . 0.0 112.394 179.662 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.592 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -68.08 -43.57 4.68 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.205 1.937 . . . . 0.0 112.239 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.79 168.82 18.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.466 1.906 . . . . 0.0 110.207 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -88.79 127.96 35.63 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.653 1.181 . . . . 0.0 111.161 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -138.79 155.32 48.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.422 1.089 . . . . 0.0 113.336 179.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -93.77 155.41 17.24 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.254 2.222 . . . . 0.0 111.725 179.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.39 114.5 21.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.678 1.591 . . . . 0.0 111.675 176.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -139.34 114.87 9.89 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.582 1.553 . . . . 0.0 111.338 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -132.74 147.39 52.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.742 1.617 . . . . 0.0 111.179 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.8 m -156.86 171.86 19.67 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.535 1.934 . . . . 0.0 111.683 -177.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -142.38 105.02 4.51 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.548 -0.72 . . . . 0.0 111.103 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -170.68 173.98 5.16 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.051 1.34 . . . . 0.0 113.397 -170.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.9 173.43 0.77 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.596 2.358 . . . . 0.0 114.273 168.101 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.9 p90 -144.14 145.34 32.05 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.022 2.129 . . . . 0.0 111.441 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 t -107.17 143.94 34.62 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.915 0.864 . . . . 0.0 112.441 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.533 HG23 HD22 ' A' ' 104' ' ' ASN . 16.0 m -149.22 -179.39 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 126.621 1.968 . . . . 0.0 111.62 -171.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.7 m -126.36 120.53 30.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.148 0.979 . . . . 0.0 111.336 174.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.31 132.69 34.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.961 0.905 . . . . 0.0 111.277 174.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -136.85 121.72 18.76 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.229 1.412 . . . . 0.0 108.53 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.6 m120 55.43 53.76 9.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.614 1.165 . . . . 0.0 112.46 -171.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 64.91 26.45 12.82 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.379 2.271 . . . . 0.0 115.04 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -156.54 132.78 6.0 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.806 1.243 . . . . 0.0 109.587 -176.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -76.06 105.37 2.07 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.735 2.957 . . . . 0.0 112.283 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.42 HG12 ' N ' ' A' ' 51' ' ' TRP . 7.3 m -104.61 15.83 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.688 1.595 . . . . 0.0 112.397 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.417 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 16.5 t-80 -154.96 145.74 22.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.696 1.135 . . . . 0.0 112.114 -176.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -102.15 137.53 40.29 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.534 1.134 . . . . 0.0 111.356 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 43.9 t -111.87 -52.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.926 0.89 . . . . 0.0 112.539 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.23 -172.43 43.45 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-N 119.194 0.906 . . . . 0.0 115.198 -171.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t -128.19 126.82 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.976 1.71 . . . . 0.0 110.786 -170.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.51 -13.12 5.2 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.746 1.165 . . . . 0.0 115.753 176.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.6 m -163.35 169.61 18.78 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 130.926 3.691 . . . . 0.0 108.469 -164.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 t -128.33 128.45 44.59 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.045 0.938 . . . . 0.0 111.383 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.52 172.98 16.54 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.366 1.46 . . . . 0.0 114.305 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.0 t -150.06 178.14 9.22 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.818 1.647 . . . . 0.0 111.768 177.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -169.73 179.85 41.89 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 125.947 1.736 . . . . 0.0 113.325 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -148.87 46.87 0.66 Allowed Glycine 0 CA--C 1.534 1.237 0 C-N-CA 124.913 1.244 . . . . 0.0 113.932 -174.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.3 m -132.65 163.6 28.58 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.597 1.559 . . . . 0.0 112.303 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.19 14.42 39.36 Favored Glycine 0 CA--C 1.539 1.594 0 C-N-CA 125.55 1.547 . . . . 0.0 115.733 -177.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.4 mt -62.72 141.36 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.309 1.844 . . . . 0.0 111.099 -175.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -140.01 15.95 2.46 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.586 1.554 . . . . 0.0 113.116 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.23 -18.78 63.92 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.9 -1.125 . . . . 0.0 113.606 -177.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -65.32 167.85 7.87 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.021 0.928 . . . . 0.0 113.137 168.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.0 m -62.48 -30.98 71.65 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.811 -1.18 . . . . 0.0 112.913 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 4.5 t 44.82 58.59 3.87 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.997 2.119 . . . . 0.0 113.67 -177.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.6 mp -57.56 -18.49 19.74 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 t -57.03 -26.53 60.47 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.358 1.863 . . . . 0.0 113.876 172.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -132.13 108.95 9.63 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.396 1.478 . . . . 0.0 111.567 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.89 4.36 60.28 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.815 1.197 . . . . 0.0 115.206 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.99 -167.49 2.1 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.085 1.354 . . . . 0.0 112.472 173.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -153.99 170.51 20.91 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.581 1.952 . . . . 0.0 110.307 -177.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.42 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.7 t-105 -56.65 -37.08 70.27 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.477 2.311 . . . . 0.0 112.698 170.544 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -42.63 91.24 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 0.0 111.357 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.3 p -85.4 -27.14 25.99 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.119 1.368 . . . . 0.0 113.941 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -51.48 -41.68 61.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.283 1.433 . . . . 0.0 112.682 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -57.56 -64.34 0.93 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.026 0.931 . . . . 0.0 110.614 172.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -59.87 -21.0 60.41 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -65.77 -51.44 59.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.307 1.843 . . . . 0.0 112.572 175.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -150.46 22.21 0.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -174.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -128.91 144.67 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.196 -1.565 . . . . 0.0 109.517 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -143.06 153.46 42.96 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -84.38 -0.45 52.72 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.733 1.613 . . . . 0.0 112.714 169.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.7 t -164.09 112.18 1.15 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.259 1.824 . . . . 0.0 111.405 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.6 ttp85 -67.99 104.53 1.76 Allowed 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.429 -1.42 . . . . 0.0 110.583 172.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -116.84 3.31 12.91 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.457 1.503 . . . . 0.0 113.193 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.444 HG22 ' H ' ' A' ' 67' ' ' CYS . 10.5 p -73.8 147.4 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.042 1.337 . . . . 0.0 112.573 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -134.6 9.18 3.64 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.92 1.688 . . . . 0.0 112.531 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.444 ' H ' HG22 ' A' ' 65' ' ' VAL . 35.2 m 51.47 38.68 22.7 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.444 2.298 . . . . 0.0 113.193 -175.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -145.33 -36.17 0.3 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 128.386 2.674 . . . . 0.0 112.655 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -100.08 -4.33 30.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.666 1.586 . . . . 0.0 113.633 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -60.27 -14.59 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.546 1.138 . . . . 0.0 113.637 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.8 ttt -53.91 -26.63 26.1 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.938 1.695 . . . . 0.0 113.568 168.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.0 t -103.49 1.98 33.05 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.95 1.7 . . . . 0.0 113.849 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -103.31 -174.2 2.49 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 125.494 1.518 . . . . 0.0 111.552 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -63.25 -20.62 65.61 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.129 -0.982 . . . . 0.0 113.582 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.38 12.32 27.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.77 1.628 . . . . 0.0 114.059 -166.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -65.2 -5.11 6.09 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.516 2.726 . . . . 0.0 114.914 -176.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.5 t60 -61.27 -4.8 1.31 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.976 2.11 . . . . 0.0 115.069 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.4 t 56.55 33.76 23.21 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.327 1.851 . . . . 0.0 113.77 -177.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 160.08 14.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.377 1.471 . . . . 0.0 112.351 176.089 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -67.04 -36.45 82.1 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.562 1.145 . . . . 0.0 113.754 -172.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -159.66 159.62 33.24 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.049 1.34 . . . . 0.0 111.841 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -140.52 127.98 21.35 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.383 0.673 . . . . 0.0 110.433 167.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.0 m -92.41 91.95 7.88 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.685 176.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -75.63 125.29 28.74 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.657 0.783 . . . . 0.0 111.043 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 91.5 mt -103.41 115.8 46.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 125.39 1.476 . . . . 0.0 107.661 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -89.49 86.17 6.7 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.67 0.748 . . . . 0.0 109.749 169.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.0 p -146.46 166.59 25.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.092 1.757 . . . . 0.0 111.959 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 29.1 mmm-85 -78.71 161.09 70.52 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 125.092 1.357 . . . . 0.0 110.422 172.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.93 -21.23 32.99 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 122.102 1.868 . . . . 0.0 114.436 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.12 -57.0 23.05 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-O 117.983 -1.008 . . . . 0.0 112.575 -178.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.22 -0.25 5.44 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.25 2.633 . . . . 0.0 115.168 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -100.96 -55.24 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 126.07 1.748 . . . . 0.0 109.833 174.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.09 -44.4 80.11 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.159 -0.963 . . . . 0.0 112.989 -179.204 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.47 -2.96 31.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -173.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.36 -35.77 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.668 0.787 . . . . 0.0 110.483 169.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.3 p -109.67 158.54 17.97 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.414 1.086 . . . . 0.0 113.308 174.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -153.26 107.72 3.12 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.318 1.847 . . . . 0.0 109.833 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.6 5.23 90.06 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.337 0.97 . . . . 0.0 114.786 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.4 mt -75.73 114.74 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.564 1.146 . . . . 0.0 111.028 -177.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.1 mt -109.58 -12.62 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 126.685 1.994 . . . . 0.0 110.861 172.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.99 5.45 3.31 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.665 2.386 . . . . 0.0 116.143 -171.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.4 t 51.39 65.73 1.4 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.58 1.552 . . . . 0.0 112.904 -172.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -154.44 157.93 39.2 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.214 1.806 . . . . 0.0 111.076 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.533 HD22 HG23 ' A' ' 16' ' ' VAL . 6.2 t-20 -142.02 -169.98 3.05 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.783 -1.198 . . . . 0.0 111.86 163.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.5 t -124.36 141.87 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.681 1.592 . . . . 0.0 108.7 170.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -51.02 142.31 12.32 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.811 1.245 . . . . 0.0 111.742 169.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.54 172.24 2.17 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.0 t -120.26 -26.28 5.5 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.199 1.399 . . . . 0.0 113.519 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.0 m -81.06 171.01 15.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.492 1.517 . . . . 0.0 112.006 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -116.54 110.56 18.73 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.504 1.122 . . . . 0.0 111.34 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -106.38 158.31 16.98 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.818 1.647 . . . . 0.0 109.893 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.45 110.75 5.53 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.634 -0.666 . . . . 0.0 110.719 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -101.03 125.51 47.65 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.635 1.574 . . . . 0.0 111.766 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 39.0 t -130.8 91.7 3.11 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.386 1.475 . . . . 0.0 110.796 -172.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -85.5 163.32 18.5 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.959 0.885 . . . . 0.0 111.87 170.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -146.05 140.59 26.9 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 158.225 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -128.82 129.35 45.49 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.983 0.913 . . . . 0.0 109.907 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.83 146.63 8.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.87 0.868 . . . . 0.0 112.687 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.02 77.77 1.68 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 122.926 1.346 . . . . 0.0 111.863 174.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 75.7 m . . . . . 0 C--O 1.252 1.221 0 C-N-CA 127.44 2.296 . . . . 0.0 112.697 177.708 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 . . . . . 0 N--CA 1.493 1.675 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.27 -48.08 0.17 Allowed 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 121.564 1.509 . . . . 0.0 113.642 -171.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 86.9 m -128.53 174.84 9.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 127.224 2.21 . . . . 0.0 109.482 169.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -105.48 145.19 31.21 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.173 1.389 . . . . 0.0 108.625 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.78 158.51 43.85 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.942 1.297 . . . . 0.0 110.923 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -100.11 159.42 15.12 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 113.22 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.57 105.7 17.03 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.654 1.582 . . . . 0.0 111.362 -169.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -131.96 112.47 12.43 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.638 1.575 . . . . 0.0 111.051 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -131.44 141.91 49.91 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.916 1.687 . . . . 0.0 111.016 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.4 m -146.74 168.06 22.31 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.807 1.643 . . . . 0.0 111.348 -175.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -141.15 103.65 4.48 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.572 -0.705 . . . . 0.0 111.296 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -171.0 173.52 5.06 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.99 1.316 . . . . 0.0 113.068 -169.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.25 171.77 0.96 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.489 2.316 . . . . 0.0 113.841 167.239 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -142.64 147.7 36.21 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.783 2.033 . . . . 0.0 111.197 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.3 t -107.58 141.34 39.19 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.896 0.879 . . . . 0.0 111.341 176.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.488 HG23 HD22 ' A' ' 104' ' ' ASN . 15.8 m -146.86 -178.92 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 126.35 1.86 . . . . 0.0 111.25 -175.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.7 m -126.77 119.24 26.39 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 121.257 -0.902 . . . . 0.0 111.45 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.2 132.4 34.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.96 0.904 . . . . 0.0 111.668 175.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -140.13 115.67 10.06 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.038 1.335 . . . . 0.0 108.796 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.7 m120 58.68 56.37 4.24 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.273 1.429 . . . . 0.0 112.397 -169.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 64.54 24.3 13.04 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.737 2.415 . . . . 0.0 115.06 169.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.86 132.71 5.43 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.827 1.251 . . . . 0.0 109.444 -173.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -76.28 106.45 2.26 Favored 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 123.794 2.996 . . . . 0.0 112.189 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.44 HG12 ' N ' ' A' ' 51' ' ' TRP . 5.9 m -101.38 14.33 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.329 1.452 . . . . 0.0 111.85 -178.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 20.8 t-80 -158.95 141.8 14.39 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.037 1.29 . . . . 0.0 112.651 -167.322 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -92.67 146.95 23.27 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.613 0.765 . . . . 0.0 112.096 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.9 t -120.1 -55.7 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 124.146 0.978 . . . . 0.0 112.436 172.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.39 -173.36 42.83 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 119.297 0.953 . . . . 0.0 115.388 -170.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -127.0 122.99 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.97 1.708 . . . . 0.0 110.235 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.54 -0.05 7.44 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 115.959 1.143 . . . . 0.0 115.959 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.1 m -170.29 165.66 8.86 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 129.28 3.032 . . . . 0.0 110.289 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.9 m -106.35 114.32 28.37 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.742 1.617 . . . . 0.0 110.839 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.25 84.09 0.69 Allowed Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.585 1.564 . . . . 0.0 113.02 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 6.1 t -69.86 168.54 14.95 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.292 1.037 . . . . 0.0 112.938 174.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 131.89 -178.2 18.09 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 126.268 1.89 . . . . 0.0 114.352 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 92.75 163.47 37.47 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 126.091 1.805 . . . . 0.0 114.431 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.6 t -155.11 95.81 1.77 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.117 1.367 . . . . 0.0 111.828 -174.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.5 8.62 71.85 Favored Glycine 0 CA--C 1.541 1.671 0 C-N-CA 124.464 1.03 . . . . 0.0 115.499 178.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 65.6 mt -75.03 145.42 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 126.227 1.811 . . . . 0.0 110.209 -177.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 25.4 p90 -135.66 15.06 3.4 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.55 1.54 . . . . 0.0 113.803 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 90.0 mt -61.31 -32.97 72.84 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.467 1.507 . . . . 0.0 113.197 177.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.93 164.12 22.92 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.086 1.355 . . . . 0.0 113.141 172.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.3 m -63.77 -29.59 70.78 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.125 -0.984 . . . . 0.0 113.141 177.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.4 t 51.12 52.16 15.51 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.976 1.71 . . . . 0.0 113.462 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.1 mp -54.46 -20.11 6.97 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.985 1.314 . . . . 0.0 114.277 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.1 m -56.33 -20.75 20.42 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.556 1.942 . . . . 0.0 114.82 171.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.27 110.64 9.05 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.49 1.516 . . . . 0.0 110.927 175.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.79 1.98 63.2 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 124.961 1.267 . . . . 0.0 115.146 -178.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.15 -170.91 2.99 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.971 1.708 . . . . 0.0 110.891 175.06 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -152.69 172.42 16.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.025 1.73 . . . . 0.0 110.395 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.44 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.5 t-105 -53.74 -36.56 62.44 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 127.079 2.152 . . . . 0.0 112.274 168.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.32 -45.44 93.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.809 0.844 . . . . 0.0 111.015 177.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.9 p -72.01 -35.61 69.47 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -54.14 -44.11 71.13 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.463 1.505 . . . . 0.0 113.065 -177.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.14 -62.04 1.91 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.367 1.067 . . . . 0.0 110.725 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.403 ' H ' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -61.65 -20.29 63.24 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -179.215 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -68.62 -54.78 14.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 113.437 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -133.17 6.7 3.9 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -172.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.12 147.49 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 O-C-N 120.387 -1.446 . . . . 0.0 110.107 -173.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -142.49 153.26 43.49 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -81.55 -5.54 58.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.857 1.663 . . . . 0.0 112.882 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.1 t -165.14 121.22 1.41 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.633 1.973 . . . . 0.0 110.569 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.0 ttp-105 -66.44 104.52 1.26 Allowed 'General case' 0 N--CA 1.473 0.711 0 O-C-N 120.488 -1.383 . . . . 0.0 110.8 174.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -113.97 2.79 15.13 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.219 1.408 . . . . 0.0 113.455 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.454 HG22 ' H ' ' A' ' 67' ' ' CYS . 9.7 p -74.7 146.03 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.115 0.966 . . . . 0.0 112.235 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -130.4 7.36 4.93 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.891 1.676 . . . . 0.0 112.742 171.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.454 ' H ' HG22 ' A' ' 65' ' ' VAL . 18.6 m 52.26 42.99 31.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.602 2.361 . . . . 0.0 113.023 -177.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -155.77 -25.61 0.11 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.405 2.282 . . . . 0.0 113.349 -178.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -106.32 -4.21 20.29 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.058 1.343 . . . . 0.0 113.94 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 pt -60.33 -12.29 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.006 1.322 . . . . 0.0 113.885 -179.024 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -24.23 28.36 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 167.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 69.8 m -91.29 -5.37 54.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.363 1.465 . . . . 0.0 114.356 174.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.4 p -103.43 -176.7 3.16 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.497 1.519 . . . . 0.0 111.927 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -64.98 -19.49 66.01 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.173 -0.954 . . . . 0.0 113.465 171.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -93.64 20.12 7.82 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.008 2.123 . . . . 0.0 113.471 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -63.94 -9.26 14.52 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.022 2.129 . . . . 0.0 114.61 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -63.55 -2.33 1.59 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.853 2.461 . . . . 0.0 115.342 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 57.82 21.03 7.08 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.149 1.78 . . . . 0.0 114.755 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.67 157.81 11.21 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.79 2.036 . . . . 0.0 114.485 -173.271 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.02 -39.46 78.4 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.081 1.752 . . . . 0.0 114.694 -168.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -159.4 157.49 30.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.161 1.384 . . . . 0.0 112.525 167.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -135.1 128.67 32.63 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.339 1.056 . . . . 0.0 110.532 167.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.1 m -88.77 99.12 12.11 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.989 0.916 . . . . 0.0 109.659 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -82.5 135.05 35.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.321 -0.862 . . . . 0.0 112.337 174.176 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 66.4 mt -107.73 111.17 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 125.702 1.601 . . . . 0.0 107.676 174.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.98 86.67 7.35 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.56 -0.713 . . . . 0.0 109.845 169.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 t -152.32 175.0 13.13 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.244 1.018 . . . . 0.0 113.338 168.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -74.61 162.68 72.62 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 128.03 2.532 . . . . 0.0 110.678 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.43 -24.94 18.7 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 122.267 1.978 . . . . 0.0 114.02 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.82 -55.53 37.36 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.397 1.079 . . . . 0.0 113.07 -176.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.26 -1.26 7.75 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.829 2.353 . . . . 0.0 114.724 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.7 t -99.89 -54.61 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.152 1.781 . . . . 0.0 109.6 174.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.403 ' HE3' ' NE1' ' A' ' 51' ' ' TRP . 0.0 OUTLIER -66.54 -46.06 77.39 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.217 -0.927 . . . . 0.0 112.983 -179.184 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.56 -2.99 31.69 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -171.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.0 mt -53.25 -35.89 24.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.793 0.837 . . . . 0.0 110.599 169.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -110.34 158.97 17.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 0.0 113.204 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -156.41 104.34 2.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.18 1.792 . . . . 0.0 109.932 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.92 3.15 85.81 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 124.465 1.031 . . . . 0.0 114.949 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.0 mt -74.82 115.48 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.542 1.171 . . . . 0.0 111.238 -177.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -108.81 -13.1 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 126.383 1.873 . . . . 0.0 110.962 171.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.06 4.1 3.82 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.517 2.327 . . . . 0.0 116.262 -170.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.4 t 53.14 64.4 1.87 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.619 1.568 . . . . 0.0 112.804 -173.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -155.49 158.23 38.19 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.399 1.88 . . . . 0.0 111.091 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.488 HD22 HG23 ' A' ' 16' ' ' VAL . 6.9 t-20 -141.52 -167.97 2.54 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.659 -1.275 . . . . 0.0 111.721 164.789 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.59 146.18 31.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 125.579 1.552 . . . . 0.0 109.603 167.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.6 tp -51.41 142.72 13.06 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.891 1.276 . . . . 0.0 112.002 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.73 173.09 1.86 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.283 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -122.99 -23.89 4.88 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.092 1.357 . . . . 0.0 113.943 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.8 m -81.42 171.07 15.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.778 1.231 . . . . 0.0 111.947 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.76 106.65 13.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.778 1.231 . . . . 0.0 111.676 -176.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -101.28 162.73 12.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.036 1.735 . . . . 0.0 110.877 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -73.3 105.64 4.79 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.694 -0.629 . . . . 0.0 110.382 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.96 122.63 38.98 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.068 1.347 . . . . 0.0 111.466 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 32.8 t -124.72 91.42 3.44 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.997 1.319 . . . . 0.0 110.726 -173.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -83.98 161.8 20.64 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.601 0.76 . . . . 0.0 111.693 171.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.76 109.78 3.7 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.115 0.966 . . . . 0.0 110.669 163.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.53 130.91 43.6 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.515 1.126 . . . . 0.0 110.828 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.4 t -57.74 150.38 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.321 1.448 . . . . 0.0 112.137 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 68.1 p -123.97 101.19 7.11 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.622 1.569 . . . . 0.0 111.453 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 55.2 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 128.078 2.551 . . . . 0.0 114.512 178.719 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.409 ' HA ' ' O ' ' A' ' 68' ' ' ASP . 91.5 mtt180 . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.61 -42.17 0.29 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.138 1.892 . . . . 0.0 113.488 -166.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.28 176.82 9.26 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.59 2.356 . . . . 0.0 109.6 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.486 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 11.4 mmpt? -115.28 131.98 56.76 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.982 1.313 . . . . 0.0 110.702 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -136.2 160.67 37.99 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.531 . . . . 0.0 112.151 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -92.2 155.83 17.73 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.631 1.972 . . . . 0.0 112.145 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 107.71 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.652 1.581 . . . . 0.0 111.395 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.1 tptt -136.56 114.73 11.57 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.686 1.595 . . . . 0.0 111.069 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -133.34 132.09 40.88 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.989 1.716 . . . . 0.0 110.609 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 66.1 m -144.87 178.48 7.98 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.523 1.929 . . . . 0.0 111.595 -172.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 m -147.01 102.11 3.48 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.588 -1.32 . . . . 0.0 110.871 178.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -163.35 173.7 12.91 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.47 1.108 . . . . 0.0 113.652 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 168.31 5.19 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 128.133 2.573 . . . . 0.0 113.433 172.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.3 p90 -139.77 140.37 36.68 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.707 1.603 . . . . 0.0 111.868 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.6 t -98.72 143.11 29.44 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.204 1.002 . . . . 0.0 111.487 174.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.486 HG23 HD22 ' A' ' 104' ' ' ASN . 16.5 m -147.22 -178.6 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 126.565 1.946 . . . . 0.0 111.193 -176.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.444 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 3.2 m -127.35 119.53 26.45 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.333 -0.854 . . . . 0.0 111.307 174.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.67 133.59 33.68 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.552 0.741 . . . . 0.0 111.248 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -138.73 114.33 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.337 1.455 . . . . 0.0 108.472 175.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.8 m120 58.27 56.44 4.48 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.0 1.32 . . . . 0.0 112.489 -170.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.01 25.02 12.65 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.492 2.317 . . . . 0.0 115.091 169.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.39 132.57 5.55 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.921 1.288 . . . . 0.0 109.553 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -76.26 105.52 2.09 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.812 3.008 . . . . 0.0 112.147 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.405 HG12 ' N ' ' A' ' 51' ' ' TRP . 8.5 m -101.02 15.14 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.106 1.363 . . . . 0.0 111.956 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.444 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 24.7 t-80 -157.47 139.82 14.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.877 1.217 . . . . 0.0 112.741 -169.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -96.75 140.58 31.12 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.721 0.808 . . . . 0.0 111.306 173.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 92.1 t -109.8 -58.06 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.073 0.949 . . . . 0.0 111.598 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.08 -173.45 45.6 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 118.648 0.658 . . . . 0.0 113.191 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.4 p -115.46 138.76 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.295 1.038 . . . . 0.0 110.981 178.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 60.46 4.69 4.1 Favored Glycine 0 CA--C 1.544 1.895 0 N-CA-C 116.992 1.557 . . . . 0.0 116.992 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -167.41 158.93 11.99 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.213 2.205 . . . . 0.0 110.749 -174.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.2 m -110.93 101.62 10.18 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.004 1.721 . . . . 0.0 111.042 172.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.07 159.13 50.29 Favored Glycine 0 CA--C 1.538 1.505 0 C-N-CA 123.333 0.492 . . . . 0.0 112.732 171.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.0 t -151.61 173.46 14.62 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.288 1.435 . . . . 0.0 111.772 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -157.41 173.59 34.87 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.739 1.638 . . . . 0.0 113.371 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -125.09 20.79 6.63 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 125.912 1.72 . . . . 0.0 114.601 -175.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.5 m -128.17 162.4 27.04 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.908 1.683 . . . . 0.0 112.5 -172.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.1 26.89 2.07 Favored Glycine 0 CA--C 1.539 1.566 0 C-N-CA 126.123 1.821 . . . . 0.0 115.961 -175.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 70.3 mt -65.81 138.84 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 126.042 1.737 . . . . 0.0 110.496 -177.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -145.04 18.94 1.6 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.988 1.315 . . . . 0.0 113.758 -174.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -67.02 -25.26 66.19 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.534 -1.353 . . . . 0.0 113.75 -176.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -64.77 167.99 6.77 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.457 1.903 . . . . 0.0 113.58 170.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.4 m -60.0 -33.09 71.52 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.986 -1.071 . . . . 0.0 112.88 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 5.0 t 44.19 63.44 1.63 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.027 2.131 . . . . 0.0 113.531 -176.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.9 mp -57.44 -15.66 7.38 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.495 1.118 . . . . 0.0 114.006 178.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.7 m -57.29 -23.14 46.55 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 126.258 1.823 . . . . 0.0 114.454 170.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.68 107.66 6.7 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.403 1.481 . . . . 0.0 111.185 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.87 -1.8 55.39 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.196 1.379 . . . . 0.0 115.069 -178.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.8 m -137.14 -167.6 2.13 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.444 1.498 . . . . 0.0 111.106 174.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -155.87 172.94 17.5 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.97 1.708 . . . . 0.0 109.421 -177.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.405 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -55.31 -37.74 67.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.51 1.924 . . . . 0.0 112.139 170.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -37.6 78.17 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.775 1.23 . . . . 0.0 112.187 -179.147 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -92.81 -25.2 18.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.778 1.231 . . . . 0.0 113.587 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -52.65 -41.62 63.94 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.531 1.532 . . . . 0.0 113.15 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -56.83 -61.54 2.36 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.081 0.953 . . . . 0.0 110.588 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -56.5 -26.35 54.15 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -65.73 -48.42 71.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.284 1.434 . . . . 0.0 112.863 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -153.16 24.51 0.55 Allowed 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.277 1.584 . . . . 0.0 115.277 -176.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -129.66 145.1 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.527 -1.358 . . . . 0.0 109.538 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.3 t -145.21 158.67 43.77 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 178.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -90.72 3.44 54.28 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.487 1.915 . . . . 0.0 112.679 167.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.1 t -164.44 113.84 1.17 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.506 1.922 . . . . 0.0 111.3 174.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -66.57 104.25 1.24 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.606 -1.309 . . . . 0.0 110.628 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -115.58 4.3 14.14 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.537 1.535 . . . . 0.0 113.374 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.0 p -72.68 145.21 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.891 1.276 . . . . 0.0 112.721 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -132.47 5.66 4.06 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.17 1.788 . . . . 0.0 113.106 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 34.6 m 52.64 39.72 28.8 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.521 2.328 . . . . 0.0 114.378 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.409 ' O ' ' HA ' ' A' ' 1' ' ' ARG . 0.8 OUTLIER -153.87 -27.35 0.13 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 128.34 2.656 . . . . 0.0 112.213 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 24.3 p30 -109.1 2.36 21.08 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.709 1.603 . . . . 0.0 113.695 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -61.58 -12.66 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.171 1.388 . . . . 0.0 113.6 177.061 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -52.44 -34.15 47.46 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.641 1.176 . . . . 0.0 112.879 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.3 t -80.7 2.3 26.53 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.119 1.368 . . . . 0.0 114.218 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.1 p -121.19 -177.45 3.52 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.967 1.707 . . . . 0.0 111.845 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -62.51 -19.66 63.83 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 172.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.73 7.31 24.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.315 1.846 . . . . 0.0 114.558 -171.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -64.07 -5.57 4.94 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.968 2.107 . . . . 0.0 114.904 -176.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -61.92 -5.45 2.12 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.435 1.894 . . . . 0.0 114.681 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.6 t 53.0 35.61 19.88 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.301 2.241 . . . . 0.0 114.847 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 160.57 17.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.868 1.667 . . . . 0.0 113.063 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -68.34 -27.32 66.16 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.059 1.744 . . . . 0.0 115.253 -171.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -162.72 159.04 23.8 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.425 1.49 . . . . 0.0 112.404 166.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -134.19 141.78 47.18 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.3 1.04 . . . . 0.0 110.557 168.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.2 m -108.2 94.12 4.9 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.978 1.311 . . . . 0.0 109.532 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -78.98 136.09 37.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.78 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 88.8 mt -113.26 115.65 50.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 126.077 1.751 . . . . 0.0 108.271 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -85.15 86.41 7.38 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.775 -0.578 . . . . 0.0 110.327 168.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.4 m -142.09 155.04 45.35 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.193 1.397 . . . . 0.0 112.748 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.1 mtp180 -70.36 161.78 74.16 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.239 1.016 . . . . 0.0 110.174 162.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.79 -22.33 37.02 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.764 1.643 . . . . 0.0 114.632 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.26 -58.19 20.6 Favored Pre-proline 0 N--CA 1.474 0.763 0 CA-C-N 119.691 1.132 . . . . 0.0 113.185 -177.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.21 0.5 5.14 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.339 2.692 . . . . 0.0 114.858 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.9 t -102.97 -55.07 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 126.515 1.926 . . . . 0.0 109.712 176.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.0 -44.86 79.27 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.27 -0.894 . . . . 0.0 112.819 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.7 -3.08 32.73 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -173.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.9 mt -53.45 -35.81 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 123.52 0.728 . . . . 0.0 110.473 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.2 p -109.29 158.94 17.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.461 1.104 . . . . 0.0 113.236 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -155.43 106.04 2.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.169 1.788 . . . . 0.0 109.961 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 4.09 87.57 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.483 1.04 . . . . 0.0 114.886 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.1 mt -75.73 115.15 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 118.5 1.15 . . . . 0.0 111.27 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.7 -11.89 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.628 1.971 . . . . 0.0 110.847 172.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 9.01 1.53 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.859 2.463 . . . . 0.0 116.1 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 83.0 p 49.27 63.76 2.02 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.757 1.623 . . . . 0.0 113.455 -172.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -154.61 155.71 35.2 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 126.715 2.006 . . . . 0.0 111.116 -176.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.486 HD22 HG23 ' A' ' 16' ' ' VAL . 6.7 t-20 -141.9 -167.23 2.4 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.722 -1.236 . . . . 0.0 111.475 162.22 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 19.2 t -127.41 143.59 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.762 1.625 . . . . 0.0 108.711 170.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -50.05 141.25 11.2 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.567 1.147 . . . . 0.0 111.968 168.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 173.2 1.28 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 172.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -119.88 -32.74 4.16 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.75 1.22 . . . . 0.0 113.406 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.8 m -74.84 172.11 12.79 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.506 1.522 . . . . 0.0 112.168 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -121.21 116.63 25.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.583 1.153 . . . . 0.0 110.923 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -113.54 157.25 22.28 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.913 1.685 . . . . 0.0 109.805 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.63 112.45 4.17 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.398 0.545 . . . . 0.0 110.106 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.96 123.07 48.83 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.372 1.469 . . . . 0.0 110.843 -170.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 28.3 t -129.46 97.42 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.63 1.172 . . . . 0.0 109.924 -167.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -87.73 159.75 18.36 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.742 0.817 . . . . 0.0 110.779 171.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -145.08 128.09 16.52 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.963 0.905 . . . . 0.0 108.769 158.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -116.39 127.66 54.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.014 1.326 . . . . 0.0 109.849 -175.374 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 36.7 t -59.14 145.22 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-O 121.263 0.554 . . . . 0.0 112.111 -176.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.7 t -132.93 103.15 5.92 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.225 1.81 . . . . 0.0 110.955 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 99.2 p . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.601 1.56 . . . . 0.0 114.702 -179.481 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.2 ptp85 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.87 -54.65 0.32 Allowed 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 121.994 1.796 . . . . 0.0 112.039 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 m -140.08 171.27 14.41 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.959 1.703 . . . . 0.0 110.477 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -92.35 130.65 37.98 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.114 1.366 . . . . 0.0 110.252 -178.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -137.54 161.04 37.46 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.412 1.085 . . . . 0.0 112.85 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -95.41 160.01 14.73 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.491 2.317 . . . . 0.0 111.665 178.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.47 106.16 18.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.957 1.703 . . . . 0.0 110.933 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -134.48 118.42 17.32 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.994 1.718 . . . . 0.0 111.377 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -125.64 152.92 44.55 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.117 1.367 . . . . 0.0 111.464 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 19.6 t -154.51 175.49 13.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.367 1.467 . . . . 0.0 111.42 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -144.88 101.65 3.67 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.956 -1.09 . . . . 0.0 110.441 173.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.72 178.64 7.72 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.082 1.353 . . . . 0.0 113.442 -178.203 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 170.78 9.16 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 128.053 2.541 . . . . 0.0 113.661 174.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -141.69 141.13 33.33 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.067 1.747 . . . . 0.0 112.065 -176.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.6 t -101.21 140.54 35.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.817 0.847 . . . . 0.0 111.793 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.488 HG23 HD22 ' A' ' 104' ' ' ASN . 15.5 m -146.58 -179.41 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 126.452 1.901 . . . . 0.0 111.251 -176.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.2 m -125.96 116.27 21.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.815 1.246 . . . . 0.0 111.04 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 m -85.29 132.32 34.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.594 0.634 . . . . 0.0 111.289 173.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -136.72 116.28 12.88 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 125.188 1.395 . . . . 0.0 108.323 174.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.6 m120 57.87 55.98 5.04 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.86 1.264 . . . . 0.0 112.38 -170.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.33 25.18 12.13 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 127.439 2.295 . . . . 0.0 115.072 169.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.09 132.71 5.33 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.844 1.257 . . . . 0.0 109.787 -174.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.99 106.71 2.3 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 124.008 3.139 . . . . 0.0 113.5 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.3 m -108.65 14.95 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.888 2.075 . . . . 0.0 112.619 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -151.66 143.91 24.02 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.612 -1.305 . . . . 0.0 111.672 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -100.63 132.68 45.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 111.425 176.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.1 t -107.85 -53.52 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.908 0.883 . . . . 0.0 111.982 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.64 -172.5 44.28 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-N 118.93 0.786 . . . . 0.0 114.504 -173.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -126.18 128.88 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.479 1.511 . . . . 0.0 109.722 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.58 2.92 8.3 Favored Glycine 0 CA--C 1.539 1.555 0 N-CA-C 116.354 1.302 . . . . 0.0 116.354 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -168.88 163.39 11.61 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 128.555 2.742 . . . . 0.0 110.232 -176.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.1 m -108.48 120.55 42.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.733 1.613 . . . . 0.0 109.848 170.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.88 148.91 51.61 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 123.621 0.629 . . . . 0.0 112.765 174.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.6 t -70.98 155.98 40.17 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.961 0.905 . . . . 0.0 112.467 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -80.84 -176.08 50.28 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.07 1.319 . . . . 0.0 113.217 170.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 83.51 32.17 25.61 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 123.94 0.781 . . . . 0.0 115.014 174.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.4 p -112.72 160.1 18.28 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.954 1.702 . . . . 0.0 113.086 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.67 3.48 61.03 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 125.42 1.486 . . . . 0.0 115.269 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 45.4 mt -63.63 136.72 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.728 1.611 . . . . 0.0 110.629 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -145.92 18.56 1.44 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.37 1.468 . . . . 0.0 113.38 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -88.19 -11.72 45.94 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 120.795 -1.191 . . . . 0.0 112.406 -173.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -72.44 168.71 17.91 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.276 1.831 . . . . 0.0 113.324 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.3 m -68.6 -33.26 73.74 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.67 0.788 . . . . 0.0 112.451 176.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.2 t 44.95 72.2 0.22 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 127.075 2.15 . . . . 0.0 113.759 -176.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mp -68.44 -0.29 4.79 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.236 1.414 . . . . 0.0 114.611 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 73.0 m -60.99 -33.2 72.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.723 1.609 . . . . 0.0 115.013 177.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.4 113.22 10.98 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.84 1.256 . . . . 0.0 110.712 -176.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.83 0.13 62.41 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 124.99 1.281 . . . . 0.0 114.741 -175.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.0 m -136.41 -168.95 2.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.705 1.602 . . . . 0.0 110.95 173.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -152.94 171.64 18.02 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.146 1.378 . . . . 0.0 110.363 -176.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.442 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.2 t-105 -55.37 -36.74 66.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.727 1.611 . . . . 0.0 111.406 167.169 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.81 -32.34 70.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.907 1.283 . . . . 0.0 112.465 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.1 p -97.94 -24.72 15.26 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.763 1.225 . . . . 0.0 113.737 175.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -52.85 -40.21 63.2 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.768 1.627 . . . . 0.0 112.992 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -58.08 -61.59 2.44 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.779 0.832 . . . . 0.0 111.196 172.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.93 -28.73 38.79 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 tmtm? -66.42 -44.84 81.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.676 1.59 . . . . 0.0 114.042 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -155.72 21.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.8 mt -127.59 146.52 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 120.145 -1.597 . . . . 0.0 109.412 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.45 154.64 43.15 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -88.89 2.1 54.3 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.949 1.7 . . . . 0.0 112.343 168.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.83 106.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.387 1.875 . . . . 0.0 111.409 174.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 ttp-105 -67.23 114.73 6.2 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.494 -1.379 . . . . 0.0 110.178 171.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -126.98 5.26 6.52 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.255 1.422 . . . . 0.0 113.293 176.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.52 HG22 ' H ' ' A' ' 67' ' ' CYS . 14.9 p -71.37 150.3 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.24 1.416 . . . . 0.0 113.125 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -132.62 3.3 3.84 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.012 1.725 . . . . 0.0 112.877 173.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.52 ' H ' HG22 ' A' ' 65' ' ' VAL 0.251 90.2 m 45.65 57.66 4.84 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.743 2.417 . . . . 0.0 112.083 -171.606 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -156.34 -43.69 0.07 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.585 2.354 . . . . 0.0 111.736 -163.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -113.47 0.02 14.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.714 2.005 . . . . 0.0 113.573 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.2 pt -60.65 -11.03 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.21 1.404 . . . . 0.0 113.966 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -25.76 29.21 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 167.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 t -89.4 -2.54 58.44 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.557 1.543 . . . . 0.0 113.794 176.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 p -108.82 -179.52 3.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.904 1.682 . . . . 0.0 111.51 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -69.45 -14.58 62.96 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 172.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -81.63 6.43 15.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.348 1.859 . . . . 0.0 114.743 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -65.23 -5.03 5.98 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 128.413 2.685 . . . . 0.0 115.237 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -62.56 -2.32 1.06 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.676 1.99 . . . . 0.0 115.25 -173.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 8.5 t 56.14 31.9 19.13 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.169 1.788 . . . . 0.0 113.263 -173.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.36 154.46 20.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.482 1.113 . . . . 0.0 112.03 176.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -63.64 -33.61 76.0 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.007 1.323 . . . . 0.0 113.692 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -164.43 160.21 20.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.097 1.759 . . . . 0.0 112.123 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t30 -138.26 123.62 19.42 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.227 1.011 . . . . 0.0 110.422 172.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 42.0 m -87.37 94.74 9.77 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.842 0.857 . . . . 0.0 109.428 173.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -78.75 132.85 37.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.002 -0.436 . . . . 0.0 111.1 172.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.1 mt -111.8 113.44 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.55 1.54 . . . . 0.0 107.966 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -85.82 84.39 7.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.89 -0.506 . . . . 0.0 110.522 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.0 m -141.2 159.03 43.07 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.998 1.319 . . . . 0.0 113.249 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -71.41 162.71 71.29 Favored Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 124.739 1.216 . . . . 0.0 111.363 162.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.22 -23.73 28.38 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.556 2.171 . . . . 0.0 114.355 176.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -60.86 -58.23 20.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-N 119.68 1.127 . . . . 0.0 112.884 -177.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.89 0.89 5.08 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.034 2.489 . . . . 0.0 114.93 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.54 -57.4 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 126.937 2.095 . . . . 0.0 110.156 177.467 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -40.03 79.67 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.335 -0.853 . . . . 0.0 112.708 -177.711 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.81 -3.5 44.82 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 62.2 mt -52.84 -36.36 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.777 0.717 . . . . 0.0 110.529 169.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.63 159.58 16.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.3 1.04 . . . . 0.0 113.081 174.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -156.0 104.99 2.32 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.535 1.534 . . . . 0.0 110.646 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.63 5.1 87.03 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.299 0.952 . . . . 0.0 114.99 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.7 mt -75.28 115.87 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.534 1.167 . . . . 0.0 111.155 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.2 mt -111.54 -11.92 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 126.629 1.972 . . . . 0.0 110.946 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 4.3 5.09 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.438 2.295 . . . . 0.0 116.007 -171.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 51.81 68.28 0.83 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.805 1.642 . . . . 0.0 113.041 -170.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -156.48 163.57 39.25 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.133 1.773 . . . . 0.0 111.018 176.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.488 HD22 HG23 ' A' ' 16' ' ' VAL . 6.8 t-20 -143.52 -165.37 2.08 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.884 -1.135 . . . . 0.0 111.338 163.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.21 146.83 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 125.448 1.499 . . . . 0.0 109.285 165.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.0 tp -50.96 142.11 12.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.623 1.169 . . . . 0.0 111.409 167.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.19 174.32 0.94 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 171.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -117.19 -32.55 4.96 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.769 1.228 . . . . 0.0 113.529 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -78.76 176.01 9.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.519 1.927 . . . . 0.0 112.325 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -121.81 111.03 16.63 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.099 -1.001 . . . . 0.0 111.49 -177.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -107.95 160.33 15.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.203 1.801 . . . . 0.0 109.935 -174.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -70.91 110.78 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.687 -0.633 . . . . 0.0 110.845 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.16 126.87 50.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.813 1.645 . . . . 0.0 110.981 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.3 t -132.23 96.9 3.98 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.686 1.194 . . . . 0.0 109.961 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -103.6 135.66 44.76 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.157 1.383 . . . . 0.0 110.16 -178.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 22.1 m -116.83 146.25 43.01 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.936 -1.102 . . . . 0.0 108.646 168.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -134.94 124.42 24.89 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.035 0.934 . . . . 0.0 109.344 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.3 t -58.01 147.37 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.015 0.926 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.7 t -136.45 86.11 2.2 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 122.782 1.277 . . . . 0.0 112.836 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 61.3 m . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.198 1.799 . . . . 0.0 112.784 173.739 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -74.94 -52.11 0.11 Allowed 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.411 2.074 . . . . 0.0 112.784 -169.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 85.9 m -140.4 168.27 20.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.575 2.35 . . . . 0.0 109.599 176.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -93.45 140.44 29.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.324 1.05 . . . . 0.0 110.22 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -137.64 160.86 38.02 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.699 1.2 . . . . 0.0 112.46 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -94.46 153.74 17.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.741 2.016 . . . . 0.0 112.01 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.18 103.59 16.25 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.381 1.473 . . . . 0.0 111.22 -174.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -133.64 118.83 18.64 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.143 1.377 . . . . 0.0 111.456 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -129.51 152.22 49.29 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.04 1.736 . . . . 0.0 110.942 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.8 m -155.23 175.11 14.28 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.92 1.688 . . . . 0.0 111.43 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -144.71 104.77 4.06 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.936 -1.103 . . . . 0.0 110.838 175.051 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -169.77 172.17 6.91 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.916 1.286 . . . . 0.0 113.405 -171.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 172.86 1.09 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 128.329 2.652 . . . . 0.0 114.224 168.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -141.17 143.01 33.98 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.639 1.975 . . . . 0.0 111.7 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.4 t -103.49 138.85 39.63 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.069 0.947 . . . . 0.0 111.097 176.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.5 m -145.45 -179.49 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 125.905 1.682 . . . . 0.0 111.435 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.6 m -126.22 117.44 23.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.608 1.163 . . . . 0.0 111.527 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.87 130.08 34.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.832 0.853 . . . . 0.0 111.201 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -138.95 112.6 8.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.064 1.346 . . . . 0.0 108.925 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.1 m120 58.82 58.51 3.21 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.154 1.382 . . . . 0.0 112.331 -172.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 62.84 27.64 16.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 127.27 2.228 . . . . 0.0 114.841 171.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.75 133.51 5.49 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.983 1.313 . . . . 0.0 109.767 -176.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 101.04 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 124.149 3.232 . . . . 0.0 112.308 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 m -96.21 1.26 10.38 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 C-N-CA 125.11 1.364 . . . . 0.0 112.447 -178.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -143.82 139.83 29.53 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 121.357 1.89 . . . . 0.0 110.997 -171.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -88.38 145.38 25.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.155 0.582 . . . . 0.0 110.294 172.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 73.6 t -114.43 -57.37 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.735 0.814 . . . . 0.0 111.426 173.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.09 -174.79 43.83 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 123.981 0.8 . . . . 0.0 112.509 -172.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.73 132.61 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.588 0.755 . . . . 0.0 112.118 -173.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.08 0.19 14.04 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 115.287 0.875 . . . . 0.0 115.287 -173.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 96.2 p -173.81 167.83 4.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.684 2.794 . . . . 0.0 110.321 -172.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.1 m -104.78 113.84 27.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.122 1.369 . . . . 0.0 110.707 172.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -82.74 74.93 2.44 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 125.228 1.394 . . . . 0.0 112.879 -177.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.5 t -65.34 163.82 14.81 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.327 1.051 . . . . 0.0 112.847 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.16 169.45 15.93 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.528 2.013 . . . . 0.0 113.823 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -90.45 73.54 1.86 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.241 1.4 . . . . 0.0 112.933 -176.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.6 p -63.45 158.34 21.01 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 176.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -116.6 22.12 11.09 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 125.886 1.708 . . . . 0.0 114.328 -175.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 60.9 mt -64.37 135.07 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 125.48 1.512 . . . . 0.0 110.264 -174.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -131.56 -1.26 3.89 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.136 1.774 . . . . 0.0 113.221 -178.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.31 -31.48 72.71 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.234 1.814 . . . . 0.0 112.326 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -144.68 161.93 37.95 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.998 2.119 . . . . 0.0 112.032 178.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 27.0 m -70.78 -24.07 62.52 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.827 1.651 . . . . 0.0 112.08 167.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.0 t 52.34 29.48 6.87 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.612 1.965 . . . . 0.0 113.519 -172.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.6 mp 53.13 85.98 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.876 2.471 . . . . 0.0 112.616 -176.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.6 t -121.79 -55.05 1.92 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.498 1.519 . . . . 0.0 113.183 -176.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -118.33 119.3 34.23 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.291 1.436 . . . . 0.0 111.579 -176.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.38 6.63 70.62 Favored Glycine 0 CA--C 1.538 1.494 0 C-N-CA 124.742 1.163 . . . . 0.0 115.253 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.7 p -88.44 175.94 7.39 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.226 2.21 . . . . 0.0 112.165 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -153.26 158.2 41.31 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 123.259 1.504 . . . . 0.0 113.429 176.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.2 t-105 -55.97 -33.61 64.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.066 1.746 . . . . 0.0 112.863 171.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -44.52 92.71 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.09 -1.006 . . . . 0.0 111.039 -178.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.8 p -81.49 -24.7 36.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.503 1.521 . . . . 0.0 114.563 173.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -51.3 -43.59 61.71 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.211 1.404 . . . . 0.0 112.126 174.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -57.89 -63.08 1.37 Allowed 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 124.596 1.158 . . . . 0.0 110.922 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -21.52 53.29 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.72 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -65.98 -48.74 70.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.354 1.461 . . . . 0.0 114.431 174.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -152.36 19.96 0.64 Allowed 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.1 mt -125.63 149.98 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.768 1.627 . . . . 0.0 108.527 177.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -144.51 156.86 44.37 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.453 0.644 . . . . 0.0 112.532 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -93.0 4.35 54.16 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.716 1.606 . . . . 0.0 112.16 169.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 t -160.73 111.76 1.83 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.647 1.979 . . . . 0.0 111.015 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.0 ttp85 -67.08 101.72 0.91 Allowed 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.564 -1.335 . . . . 0.0 110.557 172.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -113.85 4.42 15.87 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.654 1.582 . . . . 0.0 113.2 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.5 p -72.43 141.67 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.682 1.193 . . . . 0.0 112.427 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -128.7 7.94 5.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.476 1.91 . . . . 0.0 112.698 172.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.5 m 49.87 47.12 23.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.054 2.542 . . . . 0.0 113.685 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -163.0 -28.46 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.029 2.531 . . . . 0.0 111.86 179.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 27.0 p30 -105.93 0.7 26.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.465 1.506 . . . . 0.0 113.853 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 pt -60.94 -11.69 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.035 1.334 . . . . 0.0 113.686 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -23.69 28.85 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.3 p -96.11 -4.9 41.99 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.5 p -97.04 -176.01 3.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.824 1.65 . . . . 0.0 111.476 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -64.75 -18.02 64.67 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 170.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -92.7 11.79 25.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.99 1.716 . . . . 0.0 114.145 -169.08 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -63.57 -8.46 9.78 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.823 2.449 . . . . 0.0 115.229 -175.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -62.75 -7.44 4.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.504 1.921 . . . . 0.0 114.71 -173.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.2 t 38.38 61.24 1.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.947 2.099 . . . . 0.0 113.653 -166.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 161.23 26.98 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.881 1.273 . . . . 0.0 112.11 160.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.25 -32.25 73.55 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.512 1.525 . . . . 0.0 114.525 -172.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -161.84 160.2 27.83 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 169.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -135.03 118.69 17.06 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.836 0.854 . . . . 0.0 110.888 171.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 25.8 m -81.84 95.55 7.35 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.036 0.534 . . . . 0.0 109.708 172.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 -80.94 131.05 35.31 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.811 -0.556 . . . . 0.0 111.892 175.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.2 mt -106.76 115.24 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 125.38 1.472 . . . . 0.0 107.779 173.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -88.21 92.53 9.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.044 0.449 . . . . 0.0 109.89 167.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.2 t -147.44 -173.7 4.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.635 1.174 . . . . 0.0 112.999 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -99.91 162.53 20.75 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 128.368 2.667 . . . . 0.0 110.995 172.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.0 -25.23 23.11 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.431 2.087 . . . . 0.0 114.244 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -58.41 18.36 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.036 -177.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -69.3 0.35 5.42 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.336 2.69 . . . . 0.0 114.831 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.5 t -102.33 -58.66 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.85 2.06 . . . . 0.0 110.001 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.27 -38.86 82.17 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.319 -0.863 . . . . 0.0 112.777 -177.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.99 -4.49 47.29 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.5 mt -53.23 -35.02 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.858 0.754 . . . . 0.0 110.798 170.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.7 p -113.24 158.08 20.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.005 1.322 . . . . 0.0 113.077 174.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -153.93 104.73 2.69 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.942 1.697 . . . . 0.0 110.373 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.84 4.97 88.41 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.206 0.908 . . . . 0.0 114.986 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.4 mt -76.35 118.82 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 118.607 1.203 . . . . 0.0 111.131 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 3.3 mt -115.69 -6.36 11.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 126.943 2.097 . . . . 0.0 110.829 173.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.04 7.93 4.41 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.383 2.273 . . . . 0.0 115.682 -172.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 85.2 p 50.43 61.48 3.18 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.867 1.667 . . . . 0.0 113.912 -174.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -157.58 154.17 28.07 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 126.284 1.833 . . . . 0.0 110.54 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -137.99 -169.81 2.64 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.095 -1.003 . . . . 0.0 111.63 166.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.4 p -122.63 144.38 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.671 1.588 . . . . 0.0 109.354 169.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.6 tp -52.51 141.79 19.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.526 1.131 . . . . 0.0 111.49 169.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.31 172.25 1.57 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 121.923 0.868 . . . . 0.0 113.265 172.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.3 t -117.67 -30.69 5.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.817 1.247 . . . . 0.0 113.263 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.6 m -78.85 170.72 16.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.464 1.506 . . . . 0.0 112.15 177.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -118.51 108.12 14.61 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.577 1.151 . . . . 0.0 111.063 -176.401 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -100.8 161.55 13.52 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.61 1.564 . . . . 0.0 110.324 -173.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -70.38 108.34 4.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.735 -0.603 . . . . 0.0 110.125 179.086 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.35 130.4 47.52 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 124.695 1.198 . . . . 0.0 111.888 -175.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.9 t -135.93 95.36 3.2 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.096 0.959 . . . . 0.0 110.85 -172.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -86.54 162.56 17.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.723 0.773 . . . . 0.0 111.162 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.72 135.15 16.08 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.482 1.113 . . . . 0.0 108.975 157.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -120.46 130.43 54.3 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.063 1.345 . . . . 0.0 110.442 -176.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.5 145.54 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 124.006 0.922 . . . . 0.0 111.925 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.8 t -135.41 78.21 1.71 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.681 1.192 . . . . 0.0 112.354 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.253 1.254 0 C-N-CA 126.185 1.794 . . . . 0.0 112.924 172.853 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -75.24 -40.37 0.86 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.068 1.846 . . . . 0.0 113.329 -176.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.38 179.67 6.65 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.224 2.209 . . . . 0.0 110.275 -176.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -109.87 127.52 54.76 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.237 1.415 . . . . 0.0 110.373 175.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -137.91 163.62 31.02 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.531 1.132 . . . . 0.0 113.36 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.1 mtpt -104.24 157.63 17.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.59 2.356 . . . . 0.0 111.626 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.58 113.7 25.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.385 1.874 . . . . 0.0 110.84 -177.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -136.13 102.63 5.07 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.842 1.257 . . . . 0.0 113.092 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -102.61 146.07 28.72 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.285 1.434 . . . . 0.0 111.368 173.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.1 m -145.69 169.69 17.97 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.227 1.811 . . . . 0.0 111.183 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.5 m -144.44 104.32 4.06 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 120.87 -1.144 . . . . 0.0 111.039 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 17.2 p30 -170.34 173.12 5.83 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.02 1.328 . . . . 0.0 113.163 -170.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.61 175.63 1.04 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.359 2.264 . . . . 0.0 114.315 169.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -143.66 144.76 32.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.221 1.809 . . . . 0.0 111.755 177.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.5 t -104.6 141.32 36.62 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.446 1.098 . . . . 0.0 110.847 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.474 HG23 HD22 ' A' ' 104' ' ' ASN . 16.6 m -148.24 -178.31 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.024 1.73 . . . . 0.0 111.738 -173.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -127.98 115.82 19.11 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.129 1.372 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.67 132.62 34.12 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.545 0.738 . . . . 0.0 111.857 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -135.85 117.2 14.64 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.441 1.496 . . . . 0.0 108.453 173.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 8.7 m120 56.45 56.29 5.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.744 1.218 . . . . 0.0 112.357 -171.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 65.21 25.21 12.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 127.496 2.318 . . . . 0.0 115.038 169.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.93 132.34 5.21 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.784 1.234 . . . . 0.0 109.723 -174.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.71 109.81 2.97 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.595 2.863 . . . . 0.0 113.468 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.2 m -108.84 17.19 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.606 1.963 . . . . 0.0 112.686 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -153.8 144.67 22.67 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.635 -1.29 . . . . 0.0 111.871 174.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -88.25 149.23 23.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.574 0.749 . . . . 0.0 110.056 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 81.9 t -124.5 -45.86 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.657 0.783 . . . . 0.0 112.515 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.29 -179.39 48.23 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 118.98 0.809 . . . . 0.0 114.12 -175.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 p -132.36 118.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.54 1.536 . . . . 0.0 110.704 -172.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.21 2.28 58.59 Favored Glycine 0 CA--C 1.541 1.694 0 C-N-CA 124.139 0.876 . . . . 0.0 114.909 -172.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 94.0 p -173.77 169.19 4.23 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.466 2.706 . . . . 0.0 110.097 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.7 m -104.23 143.6 32.73 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.888 1.275 . . . . 0.0 109.085 165.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.88 156.71 53.48 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.518 0.58 . . . . 0.0 112.287 171.388 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.2 t -70.18 156.38 39.31 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 122.042 -0.681 . . . . 0.0 112.061 177.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -89.81 174.37 40.91 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 124.83 1.205 . . . . 0.0 114.165 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 82.19 -0.91 88.3 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.148 1.356 . . . . 0.0 116.076 174.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.5 m -79.32 162.42 25.61 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.447 1.499 . . . . 0.0 113.099 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -109.16 15.9 32.91 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 125.881 1.705 . . . . 0.0 115.403 -176.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 56.8 mt -61.72 137.42 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.656 1.583 . . . . 0.0 111.264 -174.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -143.32 19.1 1.9 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.824 1.649 . . . . 0.0 113.136 -179.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 82.0 mt -80.97 -14.9 57.54 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.685 -1.259 . . . . 0.0 112.748 -175.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -85.99 173.35 9.98 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.214 1.806 . . . . 0.0 112.821 -178.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.1 m -59.81 -34.89 73.64 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.602 1.161 . . . . 0.0 112.492 173.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 4.1 t 44.39 73.15 0.16 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.751 2.42 . . . . 0.0 114.379 -177.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.9 mp -67.03 1.67 1.86 Allowed 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 126.457 1.903 . . . . 0.0 115.834 -174.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.8 m -61.6 -32.52 72.64 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.85 115.46 12.84 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.326 1.45 . . . . 0.0 110.342 -175.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.43 0.1 67.69 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.733 1.158 . . . . 0.0 114.739 -175.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.9 m -138.4 -174.5 3.83 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.227 1.411 . . . . 0.0 110.804 173.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -158.32 175.78 13.3 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.995 1.718 . . . . 0.0 110.855 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -60.05 -34.81 73.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.732 1.613 . . . . 0.0 113.075 177.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -44.38 96.62 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.578 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.0 p -79.54 -26.76 41.36 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -52.38 -43.23 64.61 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.858 1.663 . . . . 0.0 112.889 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -57.46 -61.45 2.48 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.409 1.084 . . . . 0.0 110.813 174.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.52 -26.95 56.22 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -49.75 68.74 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.313 1.445 . . . . 0.0 114.441 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -149.57 20.57 0.92 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -174.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -127.85 147.48 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.323 . . . . 0.0 109.566 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.12 154.58 43.33 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -87.63 0.68 55.32 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.05 1.74 . . . . 0.0 112.54 167.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.5 t -164.02 105.02 0.9 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.364 1.866 . . . . 0.0 111.202 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.2 ttp85 -67.41 105.81 1.91 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.558 -1.339 . . . . 0.0 110.934 173.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -117.75 3.75 12.28 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.527 1.531 . . . . 0.0 113.116 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.9 t -79.01 143.27 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.799 1.24 . . . . 0.0 111.66 -175.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -131.96 6.42 4.28 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.746 1.619 . . . . 0.0 113.313 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.2 m 50.43 46.72 24.98 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.838 2.055 . . . . 0.0 113.751 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -152.34 -29.14 0.16 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 127.118 2.167 . . . . 0.0 113.049 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -105.05 -2.72 24.05 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.307 1.443 . . . . 0.0 113.733 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -60.26 -12.52 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.656 1.582 . . . . 0.0 114.304 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -32.34 56.16 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.911 0.884 . . . . 0.0 112.018 167.332 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.8 t -88.7 -6.44 57.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.781 1.632 . . . . 0.0 114.461 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.4 p -109.73 -174.52 2.52 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.209 1.403 . . . . 0.0 112.191 -176.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -62.04 -20.83 64.38 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 120.917 -1.115 . . . . 0.0 113.618 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -94.67 17.4 13.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.157 1.783 . . . . 0.0 113.509 -169.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -67.57 -8.44 34.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.479 2.312 . . . . 0.0 114.72 -172.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -62.15 -3.62 1.36 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.973 2.509 . . . . 0.0 115.312 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.5 t 52.33 34.23 14.48 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.254 2.222 . . . . 0.0 115.054 176.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.26 164.31 5.53 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.503 1.921 . . . . 0.0 113.453 171.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -62.99 -39.59 95.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.948 1.299 . . . . 0.0 113.979 -173.121 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -161.02 164.79 30.69 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.487 1.515 . . . . 0.0 112.631 171.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -131.4 147.19 52.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.276 1.03 . . . . 0.0 109.952 164.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 47.3 m -107.3 92.55 4.12 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.183 1.393 . . . . 0.0 109.436 176.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -80.16 124.83 29.13 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.695 0.798 . . . . 0.0 111.708 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.0 mt -99.68 117.55 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.769 1.628 . . . . 0.0 108.432 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -87.56 86.35 7.2 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.573 -0.704 . . . . 0.0 110.53 169.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.0 m -142.9 156.96 45.0 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.381 1.473 . . . . 0.0 112.965 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -71.47 162.94 70.09 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 124.699 1.199 . . . . 0.0 110.585 163.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.02 -23.39 29.65 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.076 1.851 . . . . 0.0 114.52 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -61.25 -57.64 24.34 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.059 -0.972 . . . . 0.0 113.036 -177.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.68 0.32 5.75 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.035 2.49 . . . . 0.0 114.949 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.8 t -102.78 -54.45 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.527 1.931 . . . . 0.0 109.813 176.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -45.6 76.86 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.214 -0.929 . . . . 0.0 112.712 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.96 -2.93 32.8 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 -172.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.34 -36.23 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.501 0.72 . . . . 0.0 110.376 169.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.09 158.24 17.58 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.218 1.007 . . . . 0.0 113.172 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -155.97 101.51 2.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.129 1.771 . . . . 0.0 109.992 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 2.98 79.86 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.58 1.086 . . . . 0.0 114.88 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.2 mt -73.52 116.07 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.615 1.207 . . . . 0.0 111.249 -178.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.4 mt -108.8 -13.11 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 110.874 171.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.67 5.64 2.99 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 127.623 2.369 . . . . 0.0 116.298 -169.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.9 t 52.08 64.34 1.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.446 1.499 . . . . 0.0 112.661 -172.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -155.02 160.43 41.05 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.992 1.717 . . . . 0.0 111.262 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASN . . . . . 0.474 HD22 HG23 ' A' ' 16' ' ' VAL . 6.5 t-20 -144.67 -166.73 2.47 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.682 -1.262 . . . . 0.0 111.509 163.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.62 148.68 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 125.654 1.582 . . . . 0.0 109.589 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.01 142.16 25.87 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 111.476 168.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.27 172.67 2.36 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 122.558 1.17 . . . . 0.0 113.46 171.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 18.1 p -115.89 -36.83 4.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.407 1.883 . . . . 0.0 112.93 -176.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.1 m -74.52 171.7 13.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.556 1.942 . . . . 0.0 112.708 177.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -119.54 105.01 10.81 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.588 1.155 . . . . 0.0 111.31 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -98.29 162.6 13.1 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.866 1.666 . . . . 0.0 110.309 -175.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -71.51 107.38 4.38 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.726 -0.609 . . . . 0.0 110.11 177.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -100.58 129.76 46.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.49 1.116 . . . . 0.0 111.53 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 29.5 t -130.28 94.11 3.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.436 1.494 . . . . 0.0 109.497 -172.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -87.95 164.23 15.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.398 1.094 . . . . 0.0 110.663 170.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 11.5 m -129.57 168.29 16.63 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.958 1.303 . . . . 0.0 109.096 153.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -144.43 124.21 13.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.168 -0.958 . . . . 0.0 109.632 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.6 p -55.07 146.15 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 123.916 0.887 . . . . 0.0 112.473 177.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -131.85 80.65 1.93 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.283 1.433 . . . . 0.0 111.003 174.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.2 m . . . . . 0 C--O 1.253 1.276 0 C-N-CA 127.266 2.226 . . . . 0.0 113.567 178.655 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 CA--C 1.539 0.744 0 N-CA-C 113.07 0.373 . . . . 0.0 113.07 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.26 178.21 7.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.417 1.887 . . . . 0.0 110.391 -176.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -105.64 126.81 52.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.641 1.177 . . . . 0.0 110.28 -178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -133.48 155.99 48.56 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.874 1.27 . . . . 0.0 111.694 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -100.67 153.63 19.27 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.865 1.666 . . . . 0.0 112.302 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.37 112.48 19.37 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.702 1.601 . . . . 0.0 111.788 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -132.34 119.54 20.86 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.851 1.66 . . . . 0.0 110.936 174.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -132.08 150.2 52.22 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.516 1.526 . . . . 0.0 110.895 171.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.9 t -149.93 174.92 12.15 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.163 1.385 . . . . 0.0 111.705 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -141.18 104.03 4.55 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.417 -0.802 . . . . 0.0 111.004 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -165.91 173.16 10.8 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.947 1.299 . . . . 0.0 113.038 -172.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.7 173.2 2.94 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.856 2.063 . . . . 0.0 113.427 169.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -143.15 155.88 44.66 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.402 1.881 . . . . 0.0 110.422 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.9 t -113.62 145.94 40.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.237 1.415 . . . . 0.0 111.778 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -148.67 -179.3 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 126.314 1.845 . . . . 0.0 111.774 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.9 m -124.85 119.15 28.02 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.273 1.429 . . . . 0.0 111.893 174.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.5 t -85.44 131.15 34.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.508 1.123 . . . . 0.0 111.5 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -139.53 112.53 8.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.489 1.116 . . . . 0.0 109.303 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 58.66 58.22 3.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.33 1.452 . . . . 0.0 112.421 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.44 25.55 13.35 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.583 2.353 . . . . 0.0 114.83 169.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.46 134.91 5.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.093 1.357 . . . . 0.0 109.701 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.29 111.06 3.19 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.696 2.931 . . . . 0.0 113.705 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.458 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.3 m -109.85 16.09 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 126.35 1.86 . . . . 0.0 112.761 -179.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -152.64 137.01 16.67 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.712 -1.242 . . . . 0.0 110.621 177.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -79.72 152.41 29.89 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 168.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.1 t -126.67 -47.53 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.594 0.758 . . . . 0.0 112.824 174.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.45 -174.69 46.89 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.474 1.034 . . . . 0.0 115.103 -175.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 41.3 t -125.75 121.25 59.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 109.799 -174.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 63.74 4.39 10.17 Favored Glycine 0 CA--C 1.542 1.768 0 N-CA-C 115.981 1.152 . . . . 0.0 115.981 -175.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -168.32 163.98 12.95 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.747 2.419 . . . . 0.0 110.54 -177.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.7 m . . . . . 0 CA--C 1.543 0.688 0 C-N-CA 126.05 1.74 . . . . 0.0 111.129 173.729 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 CA--C 1.542 0.665 0 CA-C-O 121.981 0.896 . . . . 0.0 109.64 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.458 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.5 t-105 -55.59 -37.22 67.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.826 1.65 . . . . 0.0 111.274 167.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -26.24 63.52 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.212 1.805 . . . . 0.0 113.123 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.8 p -107.8 -24.55 11.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.653 1.581 . . . . 0.0 113.815 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -50.19 -42.29 50.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.476 1.91 . . . . 0.0 112.666 171.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -56.22 -63.03 1.32 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.698 1.199 . . . . 0.0 110.785 173.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -58.87 -27.02 64.78 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -62.36 -54.12 45.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.667 1.187 . . . . 0.0 113.141 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.8 p80 -147.75 22.64 1.13 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -176.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -124.8 150.03 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.532 -1.355 . . . . 0.0 109.446 175.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.7 t -145.19 150.73 37.26 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -84.08 -1.14 54.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.572 1.549 . . . . 0.0 112.92 168.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -162.43 108.2 1.22 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.271 1.829 . . . . 0.0 111.312 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -68.35 108.84 3.38 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.219 -1.55 . . . . 0.0 110.806 172.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -114.45 5.78 15.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.646 1.578 . . . . 0.0 112.569 171.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -74.5 136.09 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.258 1.423 . . . . 0.0 111.562 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -125.56 3.83 7.59 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.054 1.741 . . . . 0.0 113.147 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 21.6 m 56.83 30.96 18.72 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.151 2.18 . . . . 0.0 114.651 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -146.09 -19.03 0.45 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.334 2.654 . . . . 0.0 112.929 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.31 -2.59 16.64 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.793 1.637 . . . . 0.0 113.478 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.5 pt -65.36 -4.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 125.505 1.522 . . . . 0.0 114.021 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 23.4 ptm -54.22 -28.01 38.21 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.524 1.129 . . . . 0.0 113.665 159.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.5 t -87.69 -26.94 22.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.444 1.497 . . . . 0.0 113.458 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.7 p -87.94 -178.55 6.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.866 1.266 . . . . 0.0 111.934 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -65.47 -16.0 63.21 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.932 -1.105 . . . . 0.0 113.634 176.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -90.75 19.07 5.75 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.485 1.914 . . . . 0.0 113.929 -173.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -67.47 -7.84 28.75 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.025 2.13 . . . . 0.0 114.348 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -61.99 -0.87 0.55 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 128.239 2.616 . . . . 0.0 115.882 -173.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 t 49.57 51.63 16.06 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.112 1.765 . . . . 0.0 113.182 -176.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 167.35 2.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.896 1.278 . . . . 0.0 112.52 170.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -76.78 -30.03 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.833 1.253 . . . . 0.0 112.622 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.31 169.32 17.64 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.711 2.004 . . . . 0.0 111.325 168.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -143.95 161.86 37.64 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.045 0.938 . . . . 0.0 110.396 159.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.6 m -124.01 92.3 3.64 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.153 1.381 . . . . 0.0 110.247 -177.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -78.6 121.51 24.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.248 1.019 . . . . 0.0 111.262 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.3 mt -94.43 116.05 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 124.759 1.224 . . . . 0.0 107.962 171.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -86.64 90.77 8.37 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.662 -0.649 . . . . 0.0 109.83 167.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 57.7 p -145.52 170.72 15.84 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.132 1.373 . . . . 0.0 112.494 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -78.25 163.46 61.97 Favored Pre-proline 0 N--CA 1.475 0.792 0 C-N-CA 124.367 1.067 . . . . 0.0 109.951 164.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.68 -24.44 18.42 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.167 1.912 . . . . 0.0 113.987 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.85 -55.39 46.16 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.328 -177.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.32 -1.73 8.61 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.097 2.531 . . . . 0.0 114.844 179.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 t -99.01 -54.69 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 126.212 1.805 . . . . 0.0 109.54 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.22 -45.59 80.18 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.766 0.827 . . . . 0.0 112.887 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.26 -3.72 38.05 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -171.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.0 mt -54.36 -35.46 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 123.456 0.703 . . . . 0.0 110.507 171.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 p -109.32 158.34 17.98 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.761 1.224 . . . . 0.0 113.17 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -155.92 108.44 2.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.941 1.696 . . . . 0.0 110.561 177.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.01 1.48 86.71 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 124.533 1.063 . . . . 0.0 114.977 -178.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -75.1 119.88 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.932 1.293 . . . . 0.0 111.298 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.16 -13.05 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 126.624 1.97 . . . . 0.0 110.993 173.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.86 3.68 4.97 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 127.428 2.291 . . . . 0.0 116.46 -168.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 54.08 64.55 1.79 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.469 1.507 . . . . 0.0 112.601 -172.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -158.66 152.04 22.91 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.601 1.96 . . . . 0.0 110.486 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -136.63 -169.32 2.43 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.906 -1.121 . . . . 0.0 110.835 163.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.3 p -122.71 150.82 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 125.314 1.446 . . . . 0.0 109.185 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.3 tp -50.91 138.91 18.18 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.841 0.856 . . . . 0.0 111.255 167.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.45 176.06 0.68 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.053 0.941 . . . . 0.0 111.679 173.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -117.65 -26.99 6.4 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.788 -1.195 . . . . 0.0 113.936 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -87.9 169.32 12.12 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.394 1.477 . . . . 0.0 112.38 -174.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -114.3 103.53 11.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.051 -1.031 . . . . 0.0 111.667 -174.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -98.96 158.42 15.66 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.172 1.789 . . . . 0.0 110.422 -176.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.93 106.54 3.68 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.763 -0.586 . . . . 0.0 110.549 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -95.56 123.2 38.99 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.202 1.001 . . . . 0.0 111.662 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.6 t -123.19 88.51 2.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.903 1.681 . . . . 0.0 110.927 -174.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -81.19 162.64 23.52 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.785 0.802 . . . . 0.0 111.693 168.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -152.26 127.87 10.09 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 125.104 1.362 . . . . 0.0 108.251 162.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -119.96 137.46 54.05 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.801 1.24 . . . . 0.0 110.001 -173.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.6 t -61.52 148.14 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-O 121.514 0.673 . . . . 0.0 112.365 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.9 t -137.18 94.39 2.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.081 1.352 . . . . 0.0 110.996 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.171 1.788 . . . . 0.0 112.506 178.558 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo . . . . . 0 CA--C 1.537 0.635 0 N-CA-C 113.107 0.387 . . . . 0.0 113.107 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.12 171.91 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.91 2.084 . . . . 0.0 109.619 -177.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -102.33 129.7 48.85 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.285 1.034 . . . . 0.0 110.31 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -133.31 156.26 47.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 111.871 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.97 151.98 20.72 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.074 1.35 . . . . 0.0 112.457 175.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -74.6 120.96 20.86 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.713 1.605 . . . . 0.0 111.805 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -142.24 116.12 9.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.927 1.691 . . . . 0.0 110.207 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -133.22 147.43 51.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.924 1.69 . . . . 0.0 111.002 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.7 t -154.51 175.23 13.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.544 1.538 . . . . 0.0 111.549 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -139.41 101.19 4.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.473 1.109 . . . . 0.0 110.318 171.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.02 179.54 7.91 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.592 1.157 . . . . 0.0 113.52 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.1 170.98 10.39 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 128.336 2.654 . . . . 0.0 113.732 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -142.35 141.3 32.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.06 1.744 . . . . 0.0 112.008 -176.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.6 t -102.09 142.66 33.0 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.038 0.923 . . . . 0.0 111.619 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.532 HG23 HD22 ' A' ' 104' ' ' ASN . 14.4 m -147.24 -178.7 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.559 1.944 . . . . 0.0 111.241 -175.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.0 m -125.72 117.71 24.05 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.177 -0.952 . . . . 0.0 111.525 174.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.09 131.51 34.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.783 0.833 . . . . 0.0 111.413 174.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -140.32 111.44 7.08 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.126 1.37 . . . . 0.0 108.562 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 59.9 56.79 3.33 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.409 1.484 . . . . 0.0 112.456 -169.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.41 24.66 13.24 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.723 2.409 . . . . 0.0 115.102 169.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.66 133.05 5.69 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 125.142 1.377 . . . . 0.0 109.445 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -76.42 105.55 2.1 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.874 3.05 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.429 HG12 ' N ' ' A' ' 51' ' ' TRP . 5.7 m -101.96 15.46 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.714 1.606 . . . . 0.0 112.102 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 16.6 t-80 -156.79 146.45 20.73 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 120.216 1.371 . . . . 0.0 112.759 -175.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -101.12 135.62 42.3 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.601 1.16 . . . . 0.0 111.391 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 99.6 t -110.16 -53.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.016 0.926 . . . . 0.0 112.018 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.53 -174.23 45.35 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 119.006 0.821 . . . . 0.0 114.459 -174.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 t -123.54 127.62 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 109.511 -176.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.82 4.51 7.34 Favored Glycine 0 CA--C 1.542 1.777 0 N-CA-C 116.376 1.311 . . . . 0.0 116.376 -176.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.3 t -167.87 160.82 12.65 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.269 2.228 . . . . 0.0 111.111 -175.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 86.9 m . . . . . 0 CA--C 1.543 0.7 0 C-N-CA 126.222 1.809 . . . . 0.0 110.998 172.971 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 CA--C 1.542 0.664 0 CA-C-O 122.539 1.161 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.429 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -56.24 -37.95 70.45 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.613 1.965 . . . . 0.0 111.875 166.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.1 90.29 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.941 1.297 . . . . 0.0 111.797 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.6 p -83.1 -30.84 27.64 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.316 1.446 . . . . 0.0 113.411 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -53.27 -38.68 63.29 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.68 1.592 . . . . 0.0 113.111 176.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -59.29 -62.73 1.67 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.744 0.818 . . . . 0.0 110.702 171.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -58.62 -23.94 59.98 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -64.35 -48.06 76.95 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.376 1.87 . . . . 0.0 113.257 177.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -155.15 25.19 0.42 Allowed 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.688 1.736 . . . . 0.0 115.688 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.3 mt -128.8 147.78 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.111 -1.618 . . . . 0.0 109.612 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.3 t -146.99 159.38 43.63 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -96.46 4.1 52.35 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 126.626 1.97 . . . . 0.0 112.494 168.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.0 t -161.98 115.76 1.85 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.305 1.842 . . . . 0.0 110.898 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttp-105 -67.36 106.2 2.01 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.574 -1.329 . . . . 0.0 110.724 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -115.51 3.56 14.07 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.293 1.437 . . . . 0.0 113.567 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 p -72.18 143.51 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.708 1.203 . . . . 0.0 112.368 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -130.38 6.54 4.87 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.06 1.744 . . . . 0.0 112.782 170.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.6 m 51.5 38.62 22.63 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.843 2.457 . . . . 0.0 113.962 -177.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -154.67 -27.76 0.12 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.112 2.565 . . . . 0.0 112.895 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -107.61 1.69 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.771 1.629 . . . . 0.0 113.527 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.2 pt -59.86 -13.46 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.43 1.492 . . . . 0.0 113.662 176.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -53.77 -26.05 21.82 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.065 1.346 . . . . 0.0 114.259 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -91.3 -13.23 32.99 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.082 1.353 . . . . 0.0 113.645 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.6 p -93.45 -176.0 3.97 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.792 1.637 . . . . 0.0 112.051 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -64.19 -18.39 64.45 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 169.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -93.16 11.36 28.07 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.011 1.724 . . . . 0.0 114.261 -167.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -64.98 -6.33 8.3 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 128.764 2.825 . . . . 0.0 115.01 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -62.35 -2.39 1.01 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.845 2.058 . . . . 0.0 114.805 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t 53.84 34.04 18.41 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.456 1.902 . . . . 0.0 113.874 -175.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 155.63 12.24 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.881 1.672 . . . . 0.0 112.242 174.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -71.13 -26.67 63.11 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.4 pttt -164.82 165.83 20.22 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 112.236 167.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -137.41 163.65 30.55 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.199 1.0 . . . . 0.0 111.554 166.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.0 m -127.76 92.1 3.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.275 1.43 . . . . 0.0 110.0 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.56 122.86 25.21 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.774 0.83 . . . . 0.0 110.848 175.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.9 mt -99.59 116.23 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.035 1.334 . . . . 0.0 107.812 174.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -89.37 87.35 7.07 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.313 0.578 . . . . 0.0 110.539 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 93.8 p -148.94 166.39 28.75 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.136 1.375 . . . . 0.0 112.602 171.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 30.1 mtt85 -74.17 161.72 77.08 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 124.715 1.206 . . . . 0.0 111.528 170.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.51 -22.32 38.8 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.305 2.003 . . . . 0.0 114.457 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -58.01 17.04 Favored Pre-proline 0 N--CA 1.473 0.72 0 CA-C-N 119.605 1.093 . . . . 0.0 112.714 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.77 -0.57 5.49 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 123.138 2.559 . . . . 0.0 114.94 178.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.4 t -101.14 -55.56 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 126.426 1.89 . . . . 0.0 109.7 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -45.53 81.26 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.087 -1.008 . . . . 0.0 112.971 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.59 -2.9 31.35 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -172.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.3 mt -53.44 -35.63 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.664 0.786 . . . . 0.0 110.468 169.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.5 p -110.38 159.23 17.65 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.63 1.172 . . . . 0.0 113.235 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -156.44 103.11 2.12 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.162 1.785 . . . . 0.0 110.005 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.5 3.55 81.17 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.596 1.093 . . . . 0.0 114.961 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.4 mt -75.31 116.48 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 118.63 1.215 . . . . 0.0 111.241 -178.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.4 mt -110.37 -13.44 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.516 1.926 . . . . 0.0 111.079 173.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.74 2.62 5.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 127.38 2.272 . . . . 0.0 116.298 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t 52.27 67.58 0.95 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.79 1.636 . . . . 0.0 112.507 -170.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -155.14 156.47 35.81 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.646 1.978 . . . . 0.0 110.878 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.532 HD22 HG23 ' A' ' 16' ' ' VAL . 6.1 t-20 -140.72 -171.93 3.34 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.752 -1.218 . . . . 0.0 111.702 162.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.0 t -123.78 139.85 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.647 1.579 . . . . 0.0 108.452 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 34.0 tp -48.44 140.31 8.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.624 1.17 . . . . 0.0 111.893 170.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.45 174.06 0.81 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 174.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.5 t -122.48 -21.59 5.71 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.803 1.241 . . . . 0.0 114.201 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.8 m -86.25 171.47 11.23 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.25 1.42 . . . . 0.0 111.765 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -119.01 109.85 16.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.107 0.963 . . . . 0.0 111.26 -176.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -105.09 159.93 15.45 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 110.295 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.74 108.83 3.56 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.153 0.502 . . . . 0.0 110.35 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.91 121.28 41.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.347 1.459 . . . . 0.0 111.202 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.6 t -125.25 90.44 3.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.106 1.363 . . . . 0.0 110.717 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -80.97 161.09 24.44 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.547 0.739 . . . . 0.0 110.864 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -150.44 134.71 17.09 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 120.937 -1.102 . . . . 0.0 108.185 156.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.99 141.03 52.14 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.051 1.34 . . . . 0.0 109.228 -174.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.5 t -63.36 148.96 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-O 121.701 0.763 . . . . 0.0 112.114 -177.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.3 t -139.68 85.94 2.07 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.955 1.302 . . . . 0.0 111.874 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.252 1.198 0 C-N-CA 126.533 1.933 . . . . 0.0 113.709 178.633 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo . . . . . 0 CA--C 1.537 0.672 0 CA-C-O 120.519 0.133 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -138.98 176.14 8.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.308 1.843 . . . . 0.0 110.353 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -95.27 127.34 41.24 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.568 1.147 . . . . 0.0 110.2 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -135.39 159.25 42.16 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.563 1.145 . . . . 0.0 111.957 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.33 151.68 25.67 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.907 1.683 . . . . 0.0 112.722 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.63 110.22 12.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.204 1.802 . . . . 0.0 111.742 -172.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -134.11 117.7 16.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.587 1.555 . . . . 0.0 111.372 177.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -132.35 151.6 51.79 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.806 1.643 . . . . 0.0 111.406 173.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -152.75 177.04 11.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.114 1.366 . . . . 0.0 112.012 176.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -144.41 103.98 4.03 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.044 0.938 . . . . 0.0 111.058 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.58 172.6 6.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.375 1.47 . . . . 0.0 113.224 -173.269 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.12 171.86 1.19 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 127.585 2.354 . . . . 0.0 114.355 168.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -142.65 146.27 34.3 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.559 1.944 . . . . 0.0 111.597 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.0 t -106.5 142.46 36.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.088 0.955 . . . . 0.0 111.63 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -147.14 -179.53 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.471 1.908 . . . . 0.0 111.697 -174.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.42 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.7 m -126.42 119.81 28.18 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.225 -0.922 . . . . 0.0 111.818 174.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.4 t -85.17 128.83 34.82 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.34 1.056 . . . . 0.0 111.341 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -136.5 113.31 10.3 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.023 1.329 . . . . 0.0 108.988 176.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 58.27 57.83 3.76 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.985 1.314 . . . . 0.0 112.453 -172.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.98 26.25 14.08 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.398 2.279 . . . . 0.0 114.763 170.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.53 134.16 5.96 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 124.94 1.296 . . . . 0.0 109.516 -177.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -75.32 105.46 2.09 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.698 2.932 . . . . 0.0 112.228 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.437 HG12 ' H ' ' A' ' 51' ' ' TRP . 9.9 m -99.41 11.8 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.26 1.424 . . . . 0.0 111.968 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.42 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 21.5 t-80 -155.75 142.25 18.63 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.114 1.325 . . . . 0.0 112.595 -170.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -98.02 137.6 36.59 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.391 1.076 . . . . 0.0 111.351 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.6 t -111.3 -55.49 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.133 0.973 . . . . 0.0 112.028 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.57 -173.65 43.24 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 118.983 0.811 . . . . 0.0 115.123 -171.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.9 t -127.54 124.03 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.874 1.67 . . . . 0.0 110.051 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.04 3.96 10.08 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.0 p -168.96 163.98 11.47 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.647 2.379 . . . . 0.0 110.924 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m . . . . . 0 CA--C 1.54 0.58 0 C-N-CA 125.112 1.365 . . . . 0.0 110.611 172.015 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 . . . . . 0 CA--C 1.544 0.725 0 CA-C-O 122.059 0.933 . . . . 0.0 109.687 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.437 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.4 t-105 -55.45 -37.94 68.4 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.705 2.002 . . . . 0.0 112.063 167.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -42.34 83.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.827 1.251 . . . . 0.0 111.329 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -87.82 -27.57 22.19 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.568 1.547 . . . . 0.0 114.084 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -50.48 -42.86 55.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.934 1.694 . . . . 0.0 112.782 173.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.67 -62.45 1.72 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.454 1.102 . . . . 0.0 110.797 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -60.31 -23.03 63.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -178.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -64.57 -52.58 56.89 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.34 1.456 . . . . 0.0 113.163 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -149.95 22.64 0.87 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -175.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -125.69 150.08 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 120.362 -1.461 . . . . 0.0 109.246 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.6 t -145.39 152.58 40.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -84.31 -1.81 55.97 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.156 1.782 . . . . 0.0 112.963 168.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -163.65 114.71 1.37 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.391 1.876 . . . . 0.0 111.178 176.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -66.59 105.87 1.64 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.348 -1.47 . . . . 0.0 110.683 173.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -115.18 1.29 13.81 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.275 1.43 . . . . 0.0 113.595 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.435 HG22 ' H ' ' A' ' 67' ' ' CYS . 7.7 p -72.3 143.04 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.818 1.247 . . . . 0.0 112.229 178.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -130.77 12.66 5.31 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.123 1.769 . . . . 0.0 112.226 170.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.435 ' H ' HG22 ' A' ' 65' ' ' VAL . 6.4 m 51.67 38.41 22.67 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.905 2.482 . . . . 0.0 112.704 -173.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -147.86 -43.01 0.16 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.808 2.443 . . . . 0.0 112.519 -168.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.4 p30 -93.0 -6.26 48.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.141 1.377 . . . . 0.0 113.347 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.9 pt -63.34 -10.78 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.509 1.124 . . . . 0.0 113.492 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -56.38 -19.78 16.38 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.887 1.275 . . . . 0.0 114.128 164.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.3 t -114.76 -2.33 13.02 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.425 1.89 . . . . 0.0 113.78 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.5 p -98.52 -174.37 2.79 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.122 1.369 . . . . 0.0 110.886 172.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -64.02 -18.08 63.97 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.801 -1.187 . . . . 0.0 113.622 173.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -94.53 14.03 22.12 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.867 1.667 . . . . 0.0 114.275 -165.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -66.32 -4.16 7.39 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 128.514 2.726 . . . . 0.0 114.922 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -62.96 -2.9 1.36 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.651 1.98 . . . . 0.0 115.16 -174.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.8 t 57.17 32.26 21.41 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.938 1.695 . . . . 0.0 113.596 -176.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.21 155.27 25.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.103 1.361 . . . . 0.0 112.334 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -64.62 -30.99 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -170.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.25 164.17 22.54 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.015 1.726 . . . . 0.0 111.407 166.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -128.78 159.26 36.25 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.184 0.593 . . . . 0.0 110.159 161.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.1 m -122.05 93.51 4.01 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.828 1.251 . . . . 0.0 109.578 173.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -78.25 128.0 33.08 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.563 0.745 . . . . 0.0 111.114 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.1 mt -103.4 111.77 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.385 1.474 . . . . 0.0 107.447 173.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -80.62 88.83 5.69 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.728 -0.608 . . . . 0.0 109.69 168.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 71.1 m -149.21 159.31 44.36 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.069 1.348 . . . . 0.0 112.849 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -73.39 162.75 72.88 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 124.641 1.176 . . . . 0.0 110.35 166.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.8 -23.13 30.97 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.135 1.89 . . . . 0.0 114.428 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.97 -56.84 27.99 Favored Pre-proline 0 N--CA 1.474 0.744 0 CA-C-O 117.974 -1.013 . . . . 0.0 113.183 -176.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.69 -1.12 7.87 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.982 2.455 . . . . 0.0 114.863 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.2 t -100.81 -54.32 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.282 1.833 . . . . 0.0 109.668 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -44.79 79.41 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.225 -0.922 . . . . 0.0 112.969 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.25 -4.2 37.62 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -172.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.7 mt -53.08 -35.22 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.876 0.87 . . . . 0.0 110.799 170.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.6 p -112.53 158.07 20.38 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.271 1.429 . . . . 0.0 113.315 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -154.83 107.79 2.81 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.56 1.944 . . . . 0.0 109.803 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.56 3.24 88.51 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.411 1.005 . . . . 0.0 114.957 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 51.1 mt -76.43 117.62 21.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.887 1.275 . . . . 0.0 111.037 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.98 -12.04 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 126.729 2.012 . . . . 0.0 110.964 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 3.7 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.325 2.25 . . . . 0.0 116.12 -170.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.26 67.93 0.9 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.736 1.614 . . . . 0.0 113.062 -171.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -158.53 153.56 25.25 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.164 1.786 . . . . 0.0 110.717 177.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -138.46 -170.91 2.93 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.822 -1.174 . . . . 0.0 111.128 165.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.0 t -125.59 139.85 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.431 1.492 . . . . 0.0 108.578 173.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.0 tp -48.77 139.72 9.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.502 1.121 . . . . 0.0 111.947 170.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.25 172.33 1.51 Allowed 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 174.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -120.09 -24.47 6.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.701 1.201 . . . . 0.0 113.996 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -82.07 172.68 12.94 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.233 1.413 . . . . 0.0 112.089 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -119.16 105.36 11.3 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.595 1.158 . . . . 0.0 111.382 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -100.61 162.29 13.03 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.0 1.72 . . . . 0.0 110.854 -174.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -73.49 105.37 4.81 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.759 -0.588 . . . . 0.0 110.506 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.83 123.09 39.25 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.741 1.216 . . . . 0.0 111.471 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 42.4 t -127.05 91.2 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.006 1.322 . . . . 0.0 110.892 -174.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -83.95 164.39 19.41 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.682 0.753 . . . . 0.0 111.591 169.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -154.2 119.87 5.21 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.192 -0.943 . . . . 0.0 109.025 161.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -107.66 139.46 42.17 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.325 1.05 . . . . 0.0 110.239 -174.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.14 149.55 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.174 0.589 . . . . 0.0 112.198 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.1 t -142.14 95.06 2.74 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 122.099 0.952 . . . . 0.0 112.667 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.864 2.066 . . . . 0.0 113.952 179.127 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo . . . . . 0 CA--C 1.541 0.857 0 CA-C-O 120.47 0.112 . . . . 0.0 111.989 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -144.84 -178.11 5.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.774 2.029 . . . . 0.0 110.742 -174.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -105.45 127.08 52.8 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.352 1.461 . . . . 0.0 110.418 177.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -134.34 164.29 27.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.888 1.275 . . . . 0.0 112.23 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -116.04 153.29 31.95 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.793 2.037 . . . . 0.0 112.646 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.33 113.99 22.07 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.475 1.91 . . . . 0.0 111.577 -168.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -137.87 103.06 4.88 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.641 1.576 . . . . 0.0 112.424 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -117.35 140.98 48.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.079 1.351 . . . . 0.0 111.279 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -147.2 165.68 29.3 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.648 1.579 . . . . 0.0 111.484 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -140.21 103.67 4.64 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.614 -0.679 . . . . 0.0 111.209 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.48 170.7 5.72 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.803 1.241 . . . . 0.0 113.248 -169.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 171.62 1.45 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.571 2.349 . . . . 0.0 113.89 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.5 p90 -141.83 147.0 36.51 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.336 1.854 . . . . 0.0 111.453 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.6 t -105.45 144.31 32.39 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.839 0.856 . . . . 0.0 111.063 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.8 m -148.36 -178.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.336 1.855 . . . . 0.0 111.804 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -128.09 117.66 22.03 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.022 1.329 . . . . 0.0 111.877 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 18.7 t -85.32 129.43 34.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.467 1.107 . . . . 0.0 111.729 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -135.61 114.1 11.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 125.021 1.329 . . . . 0.0 109.113 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 57.46 57.25 4.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.876 1.27 . . . . 0.0 112.445 -172.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.4 26.18 13.5 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.458 2.303 . . . . 0.0 114.745 170.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.01 134.29 5.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.111 1.365 . . . . 0.0 109.709 -177.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.55 110.08 3.03 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 123.551 2.834 . . . . 0.0 113.351 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.457 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.4 m -108.01 17.03 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 126.42 1.888 . . . . 0.0 112.347 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -153.8 141.3 19.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.66 -1.275 . . . . 0.0 111.113 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -84.69 154.23 22.6 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.124 0.57 . . . . 0.0 110.274 169.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.1 t -130.1 -44.6 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.04 -174.96 47.23 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 119.74 1.155 . . . . 0.0 115.262 -174.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -130.79 116.67 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.03 1.732 . . . . 0.0 110.024 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.34 3.29 31.06 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 115.17 0.828 . . . . 0.0 115.17 -174.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 98.4 p -167.9 167.6 12.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 128.156 2.582 . . . . 0.0 110.387 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 78.4 m . . . . . 0 CA--C 1.539 0.555 0 C-N-CA 125.256 1.422 . . . . 0.0 110.34 171.179 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 . . . . . 0 CA--C 1.542 0.65 0 CA-C-O 122.038 0.923 . . . . 0.0 109.663 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.457 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -56.48 -37.41 70.32 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 126.076 1.751 . . . . 0.0 111.734 168.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.63 -37.62 76.31 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.486 1.114 . . . . 0.0 111.731 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -90.94 -27.1 18.93 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.599 1.16 . . . . 0.0 113.926 175.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -51.07 -43.01 60.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 126.136 1.774 . . . . 0.0 113.036 174.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -56.4 -62.21 1.88 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.507 1.123 . . . . 0.0 110.961 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.59 -27.49 62.76 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.8 tptt -65.11 -51.02 63.74 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.019 1.328 . . . . 0.0 113.726 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -148.84 22.82 0.99 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -128.3 147.94 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.11 1.364 . . . . 0.0 109.434 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.4 t -147.88 154.36 40.3 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -85.65 1.51 48.97 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.21 1.804 . . . . 0.0 113.112 167.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.6 t -162.38 104.19 1.1 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.685 1.994 . . . . 0.0 110.953 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -67.33 109.06 2.98 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.546 -1.346 . . . . 0.0 110.121 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.81 5.69 17.64 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.305 1.442 . . . . 0.0 113.005 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -77.2 139.3 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.871 1.268 . . . . 0.0 111.898 -174.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -127.36 7.86 6.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.096 1.758 . . . . 0.0 112.819 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 m 53.03 37.26 24.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.424 2.29 . . . . 0.0 113.816 -178.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -151.03 -33.36 0.16 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.831 2.452 . . . . 0.0 111.853 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -97.52 -5.25 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.852 1.661 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.7 pt -62.32 -12.21 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.947 1.299 . . . . 0.0 113.633 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -55.68 -33.39 64.09 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.738 0.815 . . . . 0.0 112.387 168.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -77.54 -12.57 59.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.263 1.425 . . . . 0.0 114.207 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -100.49 -175.36 2.89 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.539 1.536 . . . . 0.0 112.422 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -63.34 -19.95 65.08 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -94.25 12.79 25.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.783 1.633 . . . . 0.0 114.199 -165.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -64.68 -5.79 6.47 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 128.999 2.919 . . . . 0.0 115.136 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -62.32 -2.06 0.91 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.739 2.016 . . . . 0.0 114.919 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.8 t 55.98 31.46 18.0 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.101 1.76 . . . . 0.0 113.981 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 156.81 24.37 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.847 1.659 . . . . 0.0 112.527 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -63.23 -34.13 76.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.654 1.182 . . . . 0.0 114.155 -171.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.4 ptmm? -162.64 160.57 25.87 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.913 1.685 . . . . 0.0 112.473 168.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -129.85 159.01 37.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.029 0.932 . . . . 0.0 110.152 161.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.9 m -123.7 92.73 3.74 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.164 1.386 . . . . 0.0 109.503 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -79.48 121.85 25.71 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.166 0.986 . . . . 0.0 111.168 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.9 mt -97.25 117.25 41.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.242 1.417 . . . . 0.0 107.897 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -89.05 90.81 8.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.249 0.547 . . . . 0.0 110.294 167.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.0 p -144.67 172.04 13.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.337 1.455 . . . . 0.0 112.311 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -79.3 164.27 55.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 124.434 1.094 . . . . 0.0 109.779 164.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 -22.88 22.03 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.179 1.92 . . . . 0.0 114.284 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.24 -54.97 49.92 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-O 118.018 -0.991 . . . . 0.0 113.293 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.95 -1.28 8.36 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.236 2.624 . . . . 0.0 114.785 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 15.7 t -99.7 -53.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 126.141 1.776 . . . . 0.0 109.708 175.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -45.37 78.83 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.36 -0.837 . . . . 0.0 112.869 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.36 -3.54 37.42 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.3 mt -53.83 -36.19 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 123.514 0.726 . . . . 0.0 110.491 170.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.2 p -108.92 158.04 18.07 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.798 1.239 . . . . 0.0 113.031 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -156.2 104.84 2.27 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.657 1.583 . . . . 0.0 110.785 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 1.84 81.36 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.656 1.122 . . . . 0.0 115.002 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.66 119.91 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.899 1.279 . . . . 0.0 111.237 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.3 mt -112.27 -13.19 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.591 1.956 . . . . 0.0 110.927 173.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.93 4.14 5.77 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.441 2.296 . . . . 0.0 116.341 -168.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 53.2 68.16 0.88 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.646 1.579 . . . . 0.0 112.998 -171.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -159.83 152.86 21.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.161 1.784 . . . . 0.0 110.907 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -141.65 -170.24 3.07 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.817 -1.177 . . . . 0.0 111.524 166.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.92 142.62 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.747 1.619 . . . . 0.0 108.656 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.1 tp -51.12 140.66 15.7 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.229 1.011 . . . . 0.0 111.721 168.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.77 172.93 1.46 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -118.42 -31.47 4.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.872 1.269 . . . . 0.0 113.354 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.5 m -74.3 170.54 15.39 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.701 1.601 . . . . 0.0 112.334 175.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -120.34 102.31 8.39 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.326 1.051 . . . . 0.0 111.601 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -95.27 161.57 14.04 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.081 1.752 . . . . 0.0 110.978 -175.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -74.63 101.35 4.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.726 0.81 . . . . 0.0 110.53 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -96.1 128.8 43.33 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.943 1.297 . . . . 0.0 112.3 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.9 t -129.6 96.09 4.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.783 1.633 . . . . 0.0 110.672 -173.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -94.17 157.34 16.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.845 0.831 . . . . 0.0 111.585 172.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -147.43 117.86 7.43 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.271 1.028 . . . . 0.0 109.474 167.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -106.36 138.12 43.11 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.632 1.173 . . . . 0.0 110.099 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.9 t -61.15 146.92 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.673 0.789 . . . . 0.0 111.624 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 5.7 t -137.91 88.56 2.33 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.894 1.33 . . . . 0.0 111.39 174.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.343 1.857 . . . . 0.0 112.935 175.046 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo . . . . . 0 CA--C 1.545 1.071 0 N-CA-C 114.453 0.905 . . . . 0.0 114.453 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.2 m -127.62 160.4 31.74 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.171 1.788 . . . . 0.0 109.782 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.0 140.55 29.38 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.509 1.124 . . . . 0.0 110.136 173.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -138.93 159.75 41.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.057 1.343 . . . . 0.0 112.32 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -92.67 156.22 17.21 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.144 2.178 . . . . 0.0 111.948 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -89.7 113.4 24.89 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.271 1.828 . . . . 0.0 111.128 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -137.16 93.06 2.78 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.884 1.274 . . . . 0.0 111.929 174.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -109.07 136.18 49.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.017 1.327 . . . . 0.0 110.758 177.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 m -143.46 171.46 14.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.591 1.556 . . . . 0.0 111.737 -174.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -143.54 104.68 4.25 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.137 -0.977 . . . . 0.0 111.439 175.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.52 172.72 4.97 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.112 1.365 . . . . 0.0 113.332 -169.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.37 173.42 1.57 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.551 2.34 . . . . 0.0 114.233 168.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -142.88 147.53 35.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.759 2.024 . . . . 0.0 111.51 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -107.25 142.55 36.83 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.028 0.931 . . . . 0.0 111.501 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.534 HG23 HD22 ' A' ' 104' ' ' ASN . 16.1 m -147.98 -178.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 126.305 1.842 . . . . 0.0 111.65 -174.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.4 m -127.06 119.69 27.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.115 0.966 . . . . 0.0 111.195 174.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.73 132.73 34.03 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.708 0.803 . . . . 0.0 111.365 174.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -137.08 118.23 14.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.365 1.466 . . . . 0.0 108.488 174.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 56.37 55.44 6.61 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.65 1.18 . . . . 0.0 112.495 -171.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.54 25.16 11.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.675 2.39 . . . . 0.0 115.038 169.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.11 133.33 6.1 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 124.779 1.232 . . . . 0.0 109.439 -175.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.0 104.57 1.93 Allowed 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.848 3.032 . . . . 0.0 112.163 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.439 HG12 ' H ' ' A' ' 51' ' ' TRP . 7.7 m -102.05 14.59 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.394 1.478 . . . . 0.0 112.194 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.417 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 18.3 t-80 -156.59 142.59 18.0 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 120.111 1.323 . . . . 0.0 112.259 -173.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -97.58 141.19 30.92 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.258 1.023 . . . . 0.0 111.216 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 78.0 t -115.71 -53.86 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.057 0.943 . . . . 0.0 112.208 177.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.8 -172.78 42.64 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 119.122 0.874 . . . . 0.0 115.089 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -128.5 122.25 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 126.006 1.722 . . . . 0.0 110.034 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.82 1.46 12.03 Favored Glycine 0 CA--C 1.541 1.672 0 N-CA-C 115.856 1.102 . . . . 0.0 115.856 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.6 t -169.08 164.63 11.29 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.879 2.472 . . . . 0.0 110.316 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.6 m . . . . . 0 CA--C 1.541 0.62 0 C-N-CA 125.841 1.657 . . . . 0.0 111.174 173.798 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 . . . . . 0 CA--C 1.539 0.522 0 CA-C-O 122.805 1.288 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.439 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.8 t-105 -54.74 -36.69 65.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.427 1.891 . . . . 0.0 112.41 170.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -26.97 68.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.753 1.221 . . . . 0.0 113.06 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.7 p -89.43 -31.6 17.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.658 1.183 . . . . 0.0 113.649 167.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.01 -39.69 72.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.89 1.676 . . . . 0.0 113.11 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -57.42 -65.43 0.63 Allowed 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.435 1.094 . . . . 0.0 110.526 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -60.67 -22.33 63.78 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -61.73 -55.09 33.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.465 1.506 . . . . 0.0 113.329 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -147.88 21.96 1.12 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -172.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.0 mt -129.22 146.84 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.095 1.358 . . . . 0.0 109.695 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.9 t -147.35 153.82 40.15 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 174.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -84.73 0.86 49.05 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.088 1.755 . . . . 0.0 113.112 168.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.2 t -161.26 105.76 1.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.529 1.932 . . . . 0.0 110.932 175.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -66.99 108.34 2.56 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.545 -1.347 . . . . 0.0 110.13 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -114.44 4.38 15.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.328 1.451 . . . . 0.0 113.026 176.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.4 t -83.4 138.04 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.133 0.973 . . . . 0.0 111.437 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -124.55 8.61 8.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.127 1.771 . . . . 0.0 112.398 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.3 m 52.03 44.64 29.37 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.385 2.274 . . . . 0.0 113.26 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -160.55 -20.07 0.06 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.201 2.2 . . . . 0.0 113.718 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -106.39 -1.98 22.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.826 1.25 . . . . 0.0 113.671 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.45 -13.72 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.434 1.493 . . . . 0.0 114.195 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 4.6 ptm -51.07 -25.11 4.53 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.23 1.412 . . . . 0.0 114.587 164.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 t -95.66 -15.58 22.62 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.663 1.585 . . . . 0.0 113.584 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 p -90.39 -174.73 4.25 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.698 1.599 . . . . 0.0 112.188 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -63.38 -20.73 65.79 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.146 -0.971 . . . . 0.0 113.572 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.27 20.01 8.7 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.606 1.963 . . . . 0.0 113.424 -170.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -65.59 -10.12 32.72 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.601 2.36 . . . . 0.0 114.537 -174.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -61.8 -3.13 1.01 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.89 2.476 . . . . 0.0 115.369 -175.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.93 25.47 6.83 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.296 1.838 . . . . 0.0 114.185 -177.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 161.3 4.27 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 113.692 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -63.98 -34.81 78.84 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.472 1.509 . . . . 0.0 114.346 -168.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -165.35 158.53 16.25 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.446 1.498 . . . . 0.0 112.421 175.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -140.43 128.23 21.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.797 1.239 . . . . 0.0 110.015 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 54.2 m -91.87 94.34 9.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.679 1.192 . . . . 0.0 110.551 171.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -79.81 125.91 30.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.243 0.617 . . . . 0.0 111.175 175.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.0 mt -99.8 114.48 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.367 1.467 . . . . 0.0 108.057 172.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -84.91 87.36 7.34 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.735 -0.603 . . . . 0.0 110.109 167.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 t -152.17 171.23 18.25 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.201 1.0 . . . . 0.0 113.138 170.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -77.07 163.85 62.6 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.975 2.11 . . . . 0.0 110.852 173.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.58 -23.2 23.48 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.347 2.031 . . . . 0.0 114.408 176.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -60.15 -57.93 23.06 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 124.605 1.162 . . . . 0.0 113.211 -177.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -70.0 -0.81 7.66 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.164 2.576 . . . . 0.0 114.813 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -100.26 -55.19 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.327 1.851 . . . . 0.0 109.549 176.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -44.2 82.39 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.224 -0.922 . . . . 0.0 112.97 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.21 -4.38 38.56 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 61.7 mt -53.17 -36.01 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.713 0.805 . . . . 0.0 110.672 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 32.0 p -110.22 159.1 17.69 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.528 1.131 . . . . 0.0 113.056 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -156.35 103.77 2.18 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.623 1.569 . . . . 0.0 110.688 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.65 3.7 85.97 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.288 0.947 . . . . 0.0 114.912 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.3 mt -74.32 115.22 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.544 1.172 . . . . 0.0 111.161 -178.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.9 mt -108.43 -14.11 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.442 1.897 . . . . 0.0 110.867 171.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.42 5.76 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.732 2.413 . . . . 0.0 116.396 -169.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.2 t 51.42 65.87 1.36 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.498 1.519 . . . . 0.0 112.862 -171.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -154.89 157.06 37.23 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.206 1.803 . . . . 0.0 111.106 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.534 HD22 HG23 ' A' ' 16' ' ' VAL . 6.2 t-20 -142.29 -170.15 3.11 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.859 -1.151 . . . . 0.0 111.778 163.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.15 142.4 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.833 1.653 . . . . 0.0 108.625 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp -49.67 140.86 10.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.587 1.155 . . . . 0.0 111.945 169.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.49 172.66 1.48 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -118.06 -30.54 5.3 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.89 1.276 . . . . 0.0 113.474 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.2 m -76.91 171.5 14.66 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.801 1.64 . . . . 0.0 112.457 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -118.84 102.34 8.73 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.434 1.094 . . . . 0.0 111.667 -176.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -95.53 161.62 13.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.007 1.723 . . . . 0.0 111.135 -176.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -75.22 100.83 4.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.327 0.651 . . . . 0.0 110.537 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.24 128.99 37.28 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.203 . . . . 0.0 112.049 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 44.4 t -130.59 90.08 2.87 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 125.654 1.581 . . . . 0.0 110.074 -175.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -88.6 160.2 17.53 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.865 0.84 . . . . 0.0 111.419 171.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.3 m -147.35 142.79 27.47 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 125.586 1.554 . . . . 0.0 107.951 164.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -132.76 128.91 37.85 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.616 1.167 . . . . 0.0 109.755 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.6 t -57.77 147.22 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.962 0.905 . . . . 0.0 111.703 -176.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.65 103.61 5.28 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.158 0.983 . . . . 0.0 112.31 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.563 1.945 . . . . 0.0 113.473 179.748 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo . . . . . 0 CA--C 1.539 0.736 0 N-CA-C 112.538 0.168 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.89 175.81 10.15 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.022 2.129 . . . . 0.0 110.119 -177.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -106.82 128.65 54.44 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.877 1.271 . . . . 0.0 110.672 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -135.22 158.19 45.01 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.78 1.232 . . . . 0.0 112.669 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.0 mtpp -89.02 155.9 19.2 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.618 2.367 . . . . 0.0 111.407 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.29 105.13 17.25 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.573 1.549 . . . . 0.0 110.513 -176.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -132.3 101.9 5.55 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.131 1.373 . . . . 0.0 112.278 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -114.08 137.51 51.63 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.608 1.563 . . . . 0.0 110.971 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.2 m -142.33 169.13 18.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.868 1.667 . . . . 0.0 111.047 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -143.54 103.79 4.14 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.077 -1.015 . . . . 0.0 111.387 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.83 172.16 6.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.799 1.24 . . . . 0.0 113.535 -170.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.81 170.28 0.43 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 128.974 2.909 . . . . 0.0 114.327 165.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.58 150.47 36.45 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.884 2.074 . . . . 0.0 111.395 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.1 t -112.29 146.25 38.55 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.845 0.831 . . . . 0.0 112.434 176.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.2 m -149.19 -177.31 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.596 1.958 . . . . 0.0 111.697 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.6 m -128.11 116.26 19.68 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 125.029 1.332 . . . . 0.0 111.908 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.5 t -83.91 130.24 34.91 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.101 0.96 . . . . 0.0 111.433 176.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -137.09 115.04 11.45 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.954 1.302 . . . . 0.0 108.969 174.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 57.53 57.31 4.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.869 1.268 . . . . 0.0 112.498 -172.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 64.4 26.1 13.48 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.254 2.222 . . . . 0.0 114.734 170.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.21 134.43 5.77 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.227 1.411 . . . . 0.0 109.528 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.498 2.799 . . . . 0.0 113.317 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.8 m -106.62 16.84 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.498 1.919 . . . . 0.0 112.566 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -153.14 142.97 22.08 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.631 -1.293 . . . . 0.0 111.322 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -84.38 154.52 22.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.986 0.514 . . . . 0.0 110.419 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.3 t -124.28 -55.49 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.571 0.749 . . . . 0.0 112.339 167.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.09 -172.34 43.25 Favored Glycine 0 CA--C 1.53 1.028 0 CA-C-N 119.028 0.831 . . . . 0.0 115.104 -170.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -127.13 123.03 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.823 1.649 . . . . 0.0 110.672 -169.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.24 1.04 8.72 Favored Glycine 0 CA--C 1.541 1.66 0 C-N-CA 124.973 1.273 . . . . 0.0 115.97 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.7 m -166.09 166.6 17.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 129.912 3.285 . . . . 0.0 108.964 -174.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t . . . . . 0 CA--C 1.541 0.606 0 C-N-CA 124.424 1.09 . . . . 0.0 111.181 -179.217 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 CA--C 1.545 0.755 0 CA-C-O 122.3 1.048 . . . . 0.0 110.611 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -56.96 -35.94 69.72 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.748 2.019 . . . . 0.0 112.297 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -32.01 70.1 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.971 1.309 . . . . 0.0 112.448 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.8 p -92.22 -28.72 16.85 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.734 1.613 . . . . 0.0 113.859 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -52.73 -45.48 67.0 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.429 1.492 . . . . 0.0 112.55 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -55.61 -60.68 3.09 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.417 1.087 . . . . 0.0 110.812 175.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 34.1 mttp -58.01 -25.26 60.87 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmtp -68.49 -54.38 17.23 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.058 1.343 . . . . 0.0 113.687 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -141.7 14.91 2.14 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.81 1.782 . . . . 0.0 115.81 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.0 mt -126.33 146.09 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 O-C-N 120.771 -1.205 . . . . 0.0 110.066 175.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -142.56 151.92 42.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.392 0.677 . . . . 0.0 112.352 170.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -87.73 0.32 55.89 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.207 1.403 . . . . 0.0 112.206 170.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 t -159.44 107.17 1.76 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.421 1.888 . . . . 0.0 110.593 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -64.35 105.41 0.92 Allowed 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.734 -1.229 . . . . 0.0 110.973 175.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -112.25 1.77 16.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.347 1.459 . . . . 0.0 113.431 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.6 p -75.22 145.52 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.087 1.355 . . . . 0.0 112.572 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -132.34 8.42 4.3 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.172 1.789 . . . . 0.0 112.782 172.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 52.1 m 51.45 37.38 19.14 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.786 2.434 . . . . 0.0 114.011 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -148.28 -22.05 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.421 2.689 . . . . 0.0 112.896 176.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -106.65 -3.37 20.72 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.564 1.546 . . . . 0.0 113.398 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.2 pt -64.37 -8.94 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 113.571 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.6 ttt -56.67 -23.28 40.66 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.153 1.381 . . . . 0.0 113.123 164.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.8 t -99.86 -3.25 32.93 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.24 1.816 . . . . 0.0 114.076 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.6 p -107.42 -176.79 3.17 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.064 1.345 . . . . 0.0 111.373 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -64.37 -17.11 63.43 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.952 -1.092 . . . . 0.0 113.463 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -92.06 17.96 8.68 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.573 1.949 . . . . 0.0 113.849 -173.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -66.61 -8.01 24.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.707 2.003 . . . . 0.0 114.27 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -60.77 -2.47 0.55 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 128.252 2.621 . . . . 0.0 115.958 -175.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.9 t 49.09 53.73 12.11 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.182 1.793 . . . . 0.0 113.058 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 167.38 2.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.598 1.159 . . . . 0.0 112.303 170.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -76.49 -29.26 56.78 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.839 1.255 . . . . 0.0 112.764 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? -170.33 161.43 8.13 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.485 2.314 . . . . 0.0 110.642 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -147.08 143.45 28.33 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.599 0.76 . . . . 0.0 110.819 164.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 56.2 m -90.88 115.07 27.64 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.063 1.345 . . . . 0.0 109.197 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.94 128.34 43.8 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.481 1.037 . . . . 0.0 111.042 165.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.5 mt -99.97 112.87 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.662 1.585 . . . . 0.0 107.062 174.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -86.82 92.18 8.89 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.538 -0.726 . . . . 0.0 109.636 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 83.6 p -146.84 177.18 9.32 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.633 1.573 . . . . 0.0 112.728 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.31 160.04 46.27 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.385 1.474 . . . . 0.0 110.503 164.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -72.66 -22.08 21.15 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.584 2.189 . . . . 0.0 114.305 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.37 -55.78 41.85 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 124.902 1.281 . . . . 0.0 112.369 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.56 -0.93 7.45 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.371 2.714 . . . . 0.0 115.187 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.73 -53.89 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.718 1.607 . . . . 0.0 110.003 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -43.93 81.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.258 -0.902 . . . . 0.0 112.747 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.5 -3.49 37.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -172.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 56.6 mt -53.73 -35.78 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.627 0.771 . . . . 0.0 110.332 170.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.5 p -111.26 157.51 20.05 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.856 1.263 . . . . 0.0 113.304 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -154.5 110.62 3.23 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.571 1.948 . . . . 0.0 109.756 175.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.47 88.53 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.645 1.117 . . . . 0.0 114.873 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -77.47 116.82 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.681 1.192 . . . . 0.0 111.067 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.8 mt -111.61 -11.4 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.786 2.034 . . . . 0.0 110.769 173.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.2 5.89 4.03 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.617 2.367 . . . . 0.0 116.118 -170.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.3 t 52.71 64.93 1.67 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.568 1.547 . . . . 0.0 112.975 -173.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -157.33 152.57 26.11 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 126.053 1.741 . . . . 0.0 110.721 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -138.71 -172.03 3.21 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.909 -1.119 . . . . 0.0 111.645 164.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.8 t -124.37 141.22 45.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 125.59 1.556 . . . . 0.0 108.51 173.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.7 tp -49.63 140.93 10.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.505 1.122 . . . . 0.0 111.784 170.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.68 174.11 0.86 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 174.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 12.5 t -122.39 -20.92 5.95 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.114 1.366 . . . . 0.0 113.762 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.4 m -85.66 171.73 11.42 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.737 1.615 . . . . 0.0 111.902 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.32 109.53 16.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.446 1.099 . . . . 0.0 111.41 -178.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -105.12 160.19 15.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.926 1.69 . . . . 0.0 110.293 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -71.67 108.79 5.19 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.708 -0.62 . . . . 0.0 110.711 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -95.66 121.96 37.92 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.573 1.149 . . . . 0.0 111.574 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.4 t -121.92 88.66 2.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.269 1.828 . . . . 0.0 109.523 -175.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -88.14 158.62 18.49 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.384 -0.823 . . . . 0.0 111.166 173.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.2 m -145.74 141.23 27.81 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.041 0.936 . . . . 0.0 108.538 162.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -133.27 128.3 35.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.211 1.405 . . . . 0.0 110.008 -173.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.8 t -59.5 145.77 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-N 118.87 0.759 . . . . 0.0 112.54 -175.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.6 t -133.02 100.19 4.81 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.777 1.631 . . . . 0.0 111.011 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 C--O 1.253 1.284 0 C-N-CA 126.564 1.945 . . . . 0.0 111.519 -178.252 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 CA--C 1.54 0.793 0 CA-C-O 120.602 0.168 . . . . 0.0 111.862 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.8 m -139.67 171.82 13.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.597 2.359 . . . . 0.0 109.813 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -91.51 137.19 32.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.716 1.207 . . . . 0.0 110.451 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -137.44 165.05 27.19 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.401 . . . . 0.0 111.94 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mtpt -98.84 159.02 15.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 127.247 2.219 . . . . 0.0 112.08 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.64 110.43 21.75 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.276 1.83 . . . . 0.0 111.583 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -135.8 115.66 13.09 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.203 1.801 . . . . 0.0 111.322 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -122.16 150.34 42.37 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.376 1.07 . . . . 0.0 111.548 176.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -150.48 170.65 18.59 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.987 1.315 . . . . 0.0 111.788 173.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -140.81 104.33 4.68 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.866 0.866 . . . . 0.0 110.963 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.6 172.99 7.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.146 1.378 . . . . 0.0 112.767 -172.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.85 172.21 1.39 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.41 1.884 . . . . 0.0 113.941 168.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -139.22 155.63 47.66 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.42 1.888 . . . . 0.0 110.161 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.5 t -113.91 146.24 40.34 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.078 1.351 . . . . 0.0 111.769 174.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.6 m -148.95 -178.45 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 126.415 1.886 . . . . 0.0 111.744 -175.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -125.51 117.73 24.24 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.96 1.304 . . . . 0.0 111.715 175.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.74 130.99 34.95 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.083 0.953 . . . . 0.0 111.503 176.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -138.51 112.66 8.61 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.127 1.371 . . . . 0.0 108.978 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 57.92 57.81 3.94 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.914 1.286 . . . . 0.0 112.451 -172.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 63.97 26.95 14.26 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.407 2.283 . . . . 0.0 114.776 170.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -160.08 134.89 5.53 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.231 1.413 . . . . 0.0 109.744 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -75.85 109.1 2.83 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.667 2.911 . . . . 0.0 113.38 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.7 m -109.27 17.56 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.611 1.965 . . . . 0.0 112.722 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -152.68 139.18 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.576 -1.328 . . . . 0.0 110.656 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -84.49 147.88 26.83 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.954 0.502 . . . . 0.0 110.879 170.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.4 t -121.28 -54.49 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.404 0.682 . . . . 0.0 112.573 175.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.87 -173.66 43.51 Favored Glycine 0 CA--C 1.528 0.865 0 CA-C-N 119.247 0.931 . . . . 0.0 115.149 -171.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 t -129.19 118.48 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.892 1.677 . . . . 0.0 110.181 -172.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.43 4.76 25.76 Favored Glycine 0 CA--C 1.542 1.75 0 N-CA-C 115.663 1.025 . . . . 0.0 115.663 -174.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.2 p -165.82 166.0 17.98 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.625 2.37 . . . . 0.0 111.123 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.0 m . . . . . 0 CA--C 1.539 0.553 0 C-N-CA 125.341 1.457 . . . . 0.0 110.526 172.486 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 p30 . . . . . 0 CA--C 1.541 0.613 0 CA-C-O 122.606 1.194 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -59.74 -35.17 74.02 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 0.0 112.943 173.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -48.11 83.04 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.501 1.12 . . . . 0.0 110.977 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.8 p -74.53 -31.18 62.05 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.42 1.488 . . . . 0.0 113.481 174.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -54.79 -41.14 70.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.055 1.342 . . . . 0.0 113.068 175.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -60.43 -61.71 2.4 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.514 0.725 . . . . 0.0 110.484 173.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.12 -21.35 59.15 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -65.13 -56.53 12.41 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.235 1.814 . . . . 0.0 113.017 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -147.45 22.81 1.16 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.529 1.678 . . . . 0.0 115.529 -172.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -126.6 147.73 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.368 1.467 . . . . 0.0 109.291 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -143.36 152.75 41.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -84.24 -1.52 55.35 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.869 1.668 . . . . 0.0 112.804 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.2 t -162.32 109.73 1.33 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.337 1.855 . . . . 0.0 110.971 176.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.4 ttp85 -67.17 106.5 2.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 120.459 -1.401 . . . . 0.0 110.556 172.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.35 3.05 13.3 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.129 1.372 . . . . 0.0 113.036 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.411 HG22 ' H ' ' A' ' 67' ' ' CYS . 13.8 p -74.64 147.26 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.775 1.23 . . . . 0.0 113.168 -174.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -132.03 2.13 3.95 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.2 1.8 . . . . 0.0 113.266 174.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.411 ' H ' HG22 ' A' ' 65' ' ' VAL . 93.8 m 45.66 54.31 7.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.447 2.299 . . . . 0.0 113.346 -174.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -152.89 -29.88 0.14 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.372 2.669 . . . . 0.0 111.751 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -108.94 -4.06 17.04 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.77 1.628 . . . . 0.0 114.136 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.9 pt -61.98 -7.74 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.9 tpt -52.46 -27.8 17.59 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.277 1.431 . . . . 0.0 113.823 169.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 99.9 p -90.45 -5.14 56.44 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 p -100.43 -179.39 4.09 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.715 1.606 . . . . 0.0 111.695 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -68.92 -15.51 63.51 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.93 5.77 18.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.319 1.848 . . . . 0.0 114.849 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -63.14 -8.19 7.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.939 2.496 . . . . 0.0 115.207 -174.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -62.07 -5.68 2.4 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.446 1.898 . . . . 0.0 114.719 -173.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 43.5 t 47.18 45.88 16.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.923 1.689 . . . . 0.0 112.69 -170.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 157.33 21.82 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.876 1.27 . . . . 0.0 111.656 167.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -63.87 -34.22 77.45 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.659 1.184 . . . . 0.0 113.993 -171.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 9.7 ptmm? -163.04 158.9 22.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.069 1.748 . . . . 0.0 111.77 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -134.02 122.33 22.86 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.638 1.175 . . . . 0.0 110.105 173.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -88.16 92.73 9.26 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.149 0.579 . . . . 0.0 110.047 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -78.66 126.05 30.2 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.884 -0.51 . . . . 0.0 111.253 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -99.12 115.57 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.833 1.253 . . . . 0.0 108.091 171.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -88.68 87.37 7.23 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.904 -0.497 . . . . 0.0 110.005 167.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.8 t -151.39 171.07 18.07 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.267 1.027 . . . . 0.0 112.998 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.6 mtp-105 -74.64 163.62 67.01 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 126.376 1.871 . . . . 0.0 110.934 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.84 -24.08 25.13 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.24 1.96 . . . . 0.0 114.393 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.54 -57.12 27.08 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.92 1.288 . . . . 0.0 112.95 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.37 -1.06 8.36 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.194 2.596 . . . . 0.0 114.602 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -99.72 -54.62 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 126.291 1.836 . . . . 0.0 109.665 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -44.96 77.61 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.41 -0.806 . . . . 0.0 112.843 -178.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.76 -4.11 38.64 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -172.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.4 mt -53.72 -35.56 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.702 0.801 . . . . 0.0 110.654 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.69 157.84 19.29 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.842 1.257 . . . . 0.0 113.196 172.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -155.45 109.26 2.83 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.985 1.714 . . . . 0.0 110.373 177.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.05 2.41 88.25 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.57 1.081 . . . . 0.0 114.909 -178.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.9 mt -76.23 118.92 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.752 1.221 . . . . 0.0 111.223 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -113.27 -9.7 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 126.887 2.075 . . . . 0.0 110.863 173.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.4 7.72 3.34 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.517 2.327 . . . . 0.0 116.01 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 79.4 p 50.24 61.8 3.01 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.711 1.605 . . . . 0.0 113.909 -173.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -156.14 155.99 33.47 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.576 1.551 . . . . 0.0 110.952 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -138.65 -171.81 3.15 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.959 -1.088 . . . . 0.0 111.106 166.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.4 t -124.87 142.34 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.294 1.437 . . . . 0.0 108.583 173.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.1 tp -47.97 137.4 10.19 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.241 1.016 . . . . 0.0 111.99 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.88 171.95 1.93 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.618 0.767 . . . . 0.0 112.293 175.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.6 t -118.27 -25.61 6.54 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.401 1.081 . . . . 0.0 113.835 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.1 m -82.4 169.81 16.01 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.655 1.182 . . . . 0.0 111.989 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -116.76 103.56 10.47 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.281 1.032 . . . . 0.0 111.4 -175.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -98.33 162.12 13.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.75 1.62 . . . . 0.0 110.96 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.64 105.81 4.41 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.918 -0.489 . . . . 0.0 110.122 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -97.93 124.62 42.45 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.615 1.166 . . . . 0.0 111.642 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.1 t -125.62 95.08 4.32 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 125.647 1.579 . . . . 0.0 110.05 -172.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.97 138.65 31.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.961 1.304 . . . . 0.0 110.506 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 43.3 m -113.32 151.4 31.24 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.95 -1.094 . . . . 0.0 108.481 161.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -135.57 123.65 22.91 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.811 0.844 . . . . 0.0 109.391 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.1 t -57.05 146.23 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.648 0.779 . . . . 0.0 111.483 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -135.65 103.63 5.5 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.235 1.014 . . . . 0.0 111.666 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.253 1.285 0 C-N-CA 126.693 1.997 . . . . 0.0 111.426 179.671 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo . . . . . 0 CA--C 1.538 0.716 0 N-CA-C 113.305 0.463 . . . . 0.0 113.305 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.4 m -136.92 -167.89 2.17 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.692 2.397 . . . . 0.0 109.352 175.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.12 146.97 43.76 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.565 1.146 . . . . 0.0 109.327 168.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -141.51 161.31 38.22 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.456 1.502 . . . . 0.0 110.423 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -105.42 158.04 16.93 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.031 1.332 . . . . 0.0 113.766 177.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.72 110.9 18.17 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.701 2.0 . . . . 0.0 111.466 -171.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -134.98 98.43 4.01 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.086 1.354 . . . . 0.0 112.234 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -116.5 137.27 52.3 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.398 1.479 . . . . 0.0 111.171 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 72.9 m -145.94 167.44 23.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.141 1.776 . . . . 0.0 111.027 -175.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 m -140.3 104.53 4.81 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.289 -0.882 . . . . 0.0 111.24 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.86 171.82 5.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.937 1.295 . . . . 0.0 113.252 -170.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.458 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -62.98 172.73 1.62 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 128.788 2.835 . . . . 0.0 113.658 168.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -143.46 145.33 32.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.569 1.948 . . . . 0.0 111.643 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.3 t -105.36 139.33 40.16 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.023 0.929 . . . . 0.0 111.277 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.523 HG23 HD22 ' A' ' 104' ' ' ASN . 15.9 m -146.88 -178.93 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.306 1.842 . . . . 0.0 111.335 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.2 m -127.03 116.02 20.09 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.688 1.195 . . . . 0.0 111.552 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -85.45 131.57 34.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.345 0.658 . . . . 0.0 111.616 173.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.84 115.45 10.62 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.22 1.408 . . . . 0.0 108.55 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 58.6 54.98 5.05 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.958 1.303 . . . . 0.0 112.335 -170.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 65.03 25.54 12.63 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.493 2.317 . . . . 0.0 115.077 169.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.6 133.08 5.73 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.962 1.305 . . . . 0.0 109.653 -175.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -75.91 108.55 2.71 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.803 3.002 . . . . 0.0 112.984 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.483 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.8 m -111.01 15.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 126.169 1.788 . . . . 0.0 113.044 -178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.4 143.67 24.07 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.139 1.336 . . . . 0.0 111.086 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -102.39 126.78 49.52 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.677 1.191 . . . . 0.0 111.407 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.6 t -101.68 -56.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.903 0.881 . . . . 0.0 111.852 -178.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.27 -171.78 41.15 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 -170.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 t -131.26 120.39 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.005 1.722 . . . . 0.0 110.168 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.27 2.29 25.34 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.579 0.992 . . . . 0.0 115.579 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.4 p -170.28 166.86 8.68 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.895 2.478 . . . . 0.0 111.079 -176.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.8 m . . . . . 0 CA--C 1.544 0.716 0 C-N-CA 125.539 1.536 . . . . 0.0 110.996 173.486 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.9 t70 . . . . . 0 CA--C 1.54 0.578 0 CA-C-O 121.688 0.756 . . . . 0.0 109.279 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.483 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.0 t-105 -54.19 -36.97 63.99 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.585 1.554 . . . . 0.0 112.293 166.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -44.41 92.02 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.901 0.881 . . . . 0.0 111.491 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.6 p -84.97 -26.05 27.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.297 1.039 . . . . 0.0 113.771 176.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -52.47 -42.3 64.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.785 1.634 . . . . 0.0 112.996 173.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -57.62 -62.54 1.72 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.056 0.942 . . . . 0.0 110.475 172.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.22 -22.13 50.73 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -67.65 -55.23 14.09 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.186 1.795 . . . . 0.0 112.44 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -146.52 22.27 1.31 Allowed 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -173.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -126.78 147.84 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 O-C-N 120.473 -1.392 . . . . 0.0 109.006 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.8 t -143.05 152.08 41.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -83.27 -1.5 53.32 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.838 1.655 . . . . 0.0 112.779 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.9 t -163.26 107.48 1.05 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.204 1.802 . . . . 0.0 111.429 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -67.92 110.54 3.91 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.376 -1.453 . . . . 0.0 110.42 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -129.33 7.71 5.42 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.603 1.561 . . . . 0.0 113.088 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.5 t -75.68 141.35 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.804 1.241 . . . . 0.0 111.983 -172.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -126.3 4.99 7.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.075 1.75 . . . . 0.0 113.437 -178.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.0 m 55.07 40.12 31.8 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 126.957 2.103 . . . . 0.0 114.26 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -152.16 -26.23 0.18 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.084 2.154 . . . . 0.0 113.432 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -99.61 -5.24 29.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.63 1.172 . . . . 0.0 113.482 176.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -64.53 -5.07 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.939 1.296 . . . . 0.0 114.435 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -53.5 -25.93 18.66 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 160.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.3 t -97.54 -15.84 20.35 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.708 1.603 . . . . 0.0 113.844 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 49.3 p -94.75 -179.81 4.99 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.014 1.326 . . . . 0.0 110.94 175.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -68.43 -11.19 59.35 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -85.52 12.54 8.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.548 2.339 . . . . 0.0 114.811 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 36.5 p90 -67.21 -8.77 34.06 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.061 2.144 . . . . 0.0 114.76 -171.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -62.59 -6.64 3.67 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.445 2.298 . . . . 0.0 115.384 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.0 t 40.55 56.02 2.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.513 1.925 . . . . 0.0 112.949 -165.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 158.87 28.17 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.223 1.409 . . . . 0.0 111.61 167.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.82 -35.48 80.8 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -172.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -160.4 156.53 26.27 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.097 1.759 . . . . 0.0 111.564 170.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -131.34 129.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.775 1.23 . . . . 0.0 109.61 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.0 m -96.83 93.84 6.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.691 0.796 . . . . 0.0 109.68 177.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -77.89 127.86 33.04 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.529 0.732 . . . . 0.0 111.394 175.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.6 mt -105.77 114.2 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.985 1.714 . . . . 0.0 107.901 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -86.35 84.2 7.51 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.822 -0.549 . . . . 0.0 110.479 170.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.8 m -141.88 158.29 43.97 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.611 1.565 . . . . 0.0 112.665 178.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -72.41 161.48 78.86 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.898 1.279 . . . . 0.0 110.762 164.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.8 -21.58 28.47 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.401 2.067 . . . . 0.0 114.375 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -61.5 -58.11 20.7 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 119.551 1.069 . . . . 0.0 112.572 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.37 0.41 5.39 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.148 2.565 . . . . 0.0 115.039 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -103.61 -54.96 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.336 1.854 . . . . 0.0 109.747 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -44.47 78.88 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.112 -0.993 . . . . 0.0 112.884 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.11 32.98 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.509 1.299 . . . . 0.0 114.509 -173.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.2 mt -52.61 -35.95 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.622 0.769 . . . . 0.0 110.645 169.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.8 p -109.8 159.99 16.72 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.286 1.034 . . . . 0.0 113.277 174.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 tptp -155.11 107.2 2.68 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.694 1.598 . . . . 0.0 110.567 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 6.29 88.67 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.275 0.941 . . . . 0.0 114.898 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.1 mt -76.56 115.39 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.518 1.159 . . . . 0.0 110.952 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 mt -112.33 -10.59 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 126.833 2.053 . . . . 0.0 110.893 173.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.96 3.79 6.32 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.406 2.282 . . . . 0.0 115.72 -173.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.1 t 53.44 66.2 1.3 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.819 1.647 . . . . 0.0 113.013 -173.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -156.46 160.53 39.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.281 1.832 . . . . 0.0 111.298 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.523 HD22 HG23 ' A' ' 16' ' ' VAL . 5.7 t-20 -142.31 -169.73 3.02 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.693 -1.254 . . . . 0.0 111.733 164.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.5 t -125.08 139.68 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.652 1.581 . . . . 0.0 108.783 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.9 tp -49.53 139.71 11.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.743 1.217 . . . . 0.0 111.836 170.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.1 172.28 1.47 Allowed 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 174.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.1 t -122.49 -30.36 3.94 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.93 1.292 . . . . 0.0 113.802 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.5 m -75.63 169.89 17.23 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.546 1.138 . . . . 0.0 111.648 171.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -123.7 105.03 9.36 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.991 0.916 . . . . 0.0 111.524 -173.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -100.28 163.76 12.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.622 1.969 . . . . 0.0 110.835 -171.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -73.86 104.16 4.64 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.724 -0.61 . . . . 0.0 110.411 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.07 131.0 44.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.089 1.355 . . . . 0.0 111.892 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.6 t -135.84 96.8 3.49 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.156 1.382 . . . . 0.0 110.801 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -93.6 155.03 17.52 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.706 0.765 . . . . 0.0 111.77 171.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.08 99.24 3.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.594 0.757 . . . . 0.0 110.979 171.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -86.59 133.05 33.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.74 1.216 . . . . 0.0 111.2 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.98 147.79 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 C-N-CA 125.075 1.35 . . . . 0.0 111.933 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 76.5 p -120.89 96.21 5.02 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.065 1.346 . . . . 0.0 111.536 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.456 1.502 . . . . 0.0 112.762 176.479 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 CA--C 1.539 0.746 0 N-CA-C 112.881 0.3 . . . . 0.0 112.881 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.0 m -141.63 168.33 20.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.157 2.183 . . . . 0.0 110.064 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -87.97 137.55 32.23 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.767 1.227 . . . . 0.0 109.997 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -137.17 160.86 37.77 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.694 1.198 . . . . 0.0 112.29 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -96.15 155.31 16.81 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.635 2.374 . . . . 0.0 111.447 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tp -80.34 127.89 32.92 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.674 1.19 . . . . 0.0 111.352 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -147.33 96.86 2.77 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.335 1.454 . . . . 0.0 112.006 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 mmtm -100.55 149.12 24.05 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.193 1.397 . . . . 0.0 111.208 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 29.6 m -155.89 169.0 25.44 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.203 1.801 . . . . 0.0 111.152 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 m -141.17 105.27 4.79 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.293 -0.88 . . . . 0.0 110.867 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.28 172.09 6.39 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.778 1.231 . . . . 0.0 113.652 -171.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.78 174.24 0.63 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 128.241 2.616 . . . . 0.0 114.515 168.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.79 143.77 31.5 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.878 2.071 . . . . 0.0 111.702 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 t -102.99 140.23 37.52 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.569 1.148 . . . . 0.0 111.095 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.527 HG23 HD22 ' A' ' 104' ' ' ASN . 15.8 m -147.18 -179.94 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 125.926 1.69 . . . . 0.0 111.711 -175.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 m -125.56 117.78 24.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.828 1.251 . . . . 0.0 111.583 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.81 131.52 34.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.625 0.77 . . . . 0.0 111.517 173.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -135.21 115.93 13.89 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.69 1.596 . . . . 0.0 108.437 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 56.47 55.82 6.2 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.688 1.195 . . . . 0.0 112.416 -171.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.59 24.83 11.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.551 2.34 . . . . 0.0 114.936 169.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -155.54 131.26 5.51 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.485 1.114 . . . . 0.0 109.567 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -76.29 102.32 1.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.975 3.116 . . . . 0.0 112.046 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.404 HG12 ' H ' ' A' ' 51' ' ' TRP . 14.7 m -90.44 -10.21 10.23 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.583 0 CA-C-O 117.728 -1.129 . . . . 0.0 112.494 -179.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -138.58 133.3 32.33 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.657 1.571 . . . . 0.0 111.041 -163.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -82.93 144.81 29.77 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.288 0.495 . . . . 0.0 110.168 171.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -116.31 -51.78 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.831 0.853 . . . . 0.0 111.652 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.81 -177.23 47.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 123.564 0.602 . . . . 0.0 113.018 -176.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -124.56 133.3 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.522 1.129 . . . . 0.0 111.494 -174.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.7 -6.58 6.11 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.551 1.072 . . . . 0.0 115.616 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -173.6 169.04 4.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.538 3.135 . . . . 0.0 109.201 -168.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.6 m . . . . . 0 CA--C 1.539 0.546 0 C-N-CA 125.592 1.557 . . . . 0.0 110.683 173.16 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.2 t0 . . . . . 0 CA--C 1.538 0.485 0 CA-C-O 122.554 1.169 . . . . 0.0 111.889 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.404 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.6 t-105 -50.27 -37.25 35.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.044 1.738 . . . . 0.0 111.813 162.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -27.21 64.48 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.471 1.508 . . . . 0.0 113.019 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.2 p -106.78 -20.5 13.32 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.837 1.655 . . . . 0.0 113.942 174.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -51.3 -40.97 60.14 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.136 1.774 . . . . 0.0 112.557 171.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -58.13 -65.21 0.68 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.779 1.232 . . . . 0.0 110.519 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.01 -21.76 63.9 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -177.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -63.14 -48.04 80.17 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.1 1.76 . . . . 0.0 113.674 174.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -154.39 21.25 0.48 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 115.759 1.762 . . . . 0.0 115.759 -175.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.5 mt -128.47 147.3 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.354 1.461 . . . . 0.0 109.386 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -144.71 154.48 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 176.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -86.63 0.44 54.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.076 1.75 . . . . 0.0 112.591 167.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.67 109.88 1.27 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.443 1.897 . . . . 0.0 111.279 176.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 ttp85 -66.96 104.49 1.39 Allowed 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.473 -1.392 . . . . 0.0 110.304 171.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -114.79 5.7 15.31 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.833 1.653 . . . . 0.0 112.677 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 85.7 t -81.73 139.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.241 1.016 . . . . 0.0 111.454 -173.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -126.37 8.07 7.11 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.201 1.8 . . . . 0.0 112.539 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 28.3 m 53.33 40.9 32.0 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.27 2.228 . . . . 0.0 113.487 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -153.16 -26.44 0.15 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 127.818 2.447 . . . . 0.0 112.851 178.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -99.43 -5.11 30.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.746 1.218 . . . . 0.0 113.808 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -63.98 -8.24 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.837 1.255 . . . . 0.0 114.136 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.2 tmm? -55.71 -31.01 62.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.152 0.981 . . . . 0.0 112.677 163.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.5 m -88.98 -9.16 52.44 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.572 1.549 . . . . 0.0 114.671 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.4 p -106.14 179.15 4.35 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.261 1.425 . . . . 0.0 111.218 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -65.61 -15.59 62.89 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.551 -1.343 . . . . 0.0 114.097 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.9 7.52 8.7 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 127.42 2.288 . . . . 0.0 114.694 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -63.79 -8.06 9.62 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.126 2.171 . . . . 0.0 115.093 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 58.7 t60 -61.29 -10.74 7.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.217 1.807 . . . . 0.0 114.796 -174.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.1 t 39.55 62.45 1.18 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.968 2.107 . . . . 0.0 113.249 -165.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 159.97 32.02 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.741 161.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.54 -31.32 72.32 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.36 1.464 . . . . 0.0 114.625 -171.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.6 ptmm? -160.4 156.49 26.22 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.576 1.55 . . . . 0.0 111.541 168.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -128.22 149.28 50.53 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.857 0.863 . . . . 0.0 110.231 168.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.9 m -115.33 91.8 3.72 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.049 0.94 . . . . 0.0 109.769 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -80.25 128.12 33.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.278 0.561 . . . . 0.0 111.266 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 82.6 mt -105.93 113.69 43.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.001 1.721 . . . . 0.0 107.432 176.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -84.24 89.08 7.27 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.676 -0.64 . . . . 0.0 110.022 168.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 64.3 p -149.07 164.49 34.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.511 1.124 . . . . 0.0 112.811 171.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -76.45 161.77 73.39 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.701 1.2 . . . . 0.0 110.611 171.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -68.99 -21.35 37.2 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.028 1.819 . . . . 0.0 114.563 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.95 -57.38 21.67 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 119.483 1.038 . . . . 0.0 113.015 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.2 -0.46 5.69 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.446 2.764 . . . . 0.0 115.157 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -101.41 -56.42 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 109.577 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.04 -43.76 86.62 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.229 -0.919 . . . . 0.0 113.031 -179.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.93 -3.28 34.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 64.5 mt -53.5 -35.8 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.529 0.732 . . . . 0.0 110.615 170.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.0 p -109.02 159.26 16.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.284 1.034 . . . . 0.0 113.262 174.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -153.91 102.07 2.48 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.845 1.658 . . . . 0.0 110.577 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.85 5.47 87.91 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.175 0.893 . . . . 0.0 114.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.8 mt -73.82 115.68 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-N 118.635 1.217 . . . . 0.0 111.177 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -109.42 -12.1 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 126.614 1.966 . . . . 0.0 110.809 171.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.15 5.68 4.18 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.477 2.311 . . . . 0.0 116.217 -170.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.0 t 52.38 64.87 1.69 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.446 1.498 . . . . 0.0 112.741 -173.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -156.13 158.05 37.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 126.279 1.832 . . . . 0.0 111.058 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.527 HD22 HG23 ' A' ' 16' ' ' VAL . 6.0 t-20 -144.34 -169.59 3.17 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.747 -1.22 . . . . 0.0 111.839 163.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.84 141.37 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 125.681 1.592 . . . . 0.0 108.735 171.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.2 tp -50.73 141.6 12.69 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.682 1.193 . . . . 0.0 111.889 170.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.58 171.49 1.98 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 173.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -122.4 -20.46 6.09 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.804 1.242 . . . . 0.0 114.017 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 41.1 m -83.96 170.37 14.06 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.07 1.348 . . . . 0.0 111.63 174.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -117.57 106.02 12.68 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.576 1.151 . . . . 0.0 111.023 -178.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -98.93 159.2 15.12 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.714 1.606 . . . . 0.0 110.341 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -70.52 106.94 3.63 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.944 -0.472 . . . . 0.0 110.232 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.48 132.31 44.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.952 1.301 . . . . 0.0 111.789 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.4 t -136.11 93.57 2.93 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.746 1.219 . . . . 0.0 109.87 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.8 159.28 17.82 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.733 0.813 . . . . 0.0 110.488 171.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.07 139.79 29.13 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.257 1.023 . . . . 0.0 109.371 161.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -124.13 125.94 45.34 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.545 1.138 . . . . 0.0 110.573 -174.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.07 145.34 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.561 0.744 . . . . 0.0 111.634 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.2 t -135.9 105.69 6.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.471 1.108 . . . . 0.0 111.453 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.6 t . . . . . 0 C--O 1.254 1.33 0 C-N-CA 126.539 1.936 . . . . 0.0 111.56 -179.402 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo . . . . . 0 CA--C 1.544 0.982 0 N-CA-C 114.126 0.779 . . . . 0.0 114.126 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 m -135.18 165.97 24.18 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.804 2.042 . . . . 0.0 109.817 171.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.549 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.6 mmpt? -95.34 142.74 27.37 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.942 0.897 . . . . 0.0 110.983 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -136.91 156.14 48.85 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.509 1.524 . . . . 0.0 110.995 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.97 151.64 19.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.17 1.388 . . . . 0.0 112.302 172.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.6 110.31 16.85 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.743 2.017 . . . . 0.0 111.372 -174.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -130.36 116.97 19.04 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.544 1.537 . . . . 0.0 111.466 175.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -130.35 150.43 51.59 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.968 1.707 . . . . 0.0 110.835 174.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.8 m -156.69 173.9 16.27 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.198 1.799 . . . . 0.0 111.43 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -144.27 101.49 3.71 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.067 -1.021 . . . . 0.0 110.861 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.13 175.8 8.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.192 1.397 . . . . 0.0 113.108 -176.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.417 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -65.21 170.02 5.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.162 2.585 . . . . 0.0 113.276 172.545 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -140.37 143.76 35.89 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.736 1.614 . . . . 0.0 111.811 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.7 t -102.21 143.99 31.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.916 0.865 . . . . 0.0 111.232 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -147.5 -178.05 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.455 1.902 . . . . 0.0 111.597 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.3 m -126.91 115.4 19.22 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.768 1.227 . . . . 0.0 111.612 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.9 t -83.29 129.87 35.03 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.113 0.965 . . . . 0.0 111.497 176.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.11 113.0 8.13 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.51 1.124 . . . . 0.0 108.538 177.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.7 59.46 3.22 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.522 1.529 . . . . 0.0 113.025 -169.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 62.84 26.46 15.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.599 2.359 . . . . 0.0 114.8 169.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.43 134.7 5.8 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 125.317 1.447 . . . . 0.0 109.559 -176.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.41 107.97 2.6 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.644 2.896 . . . . 0.0 113.072 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.446 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.9 m -108.31 17.58 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.777 2.031 . . . . 0.0 112.603 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -153.27 140.53 19.52 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.137 1.335 . . . . 0.0 110.589 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -86.07 148.2 25.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.928 0.491 . . . . 0.0 110.387 170.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.4 t -119.0 -58.8 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 123.675 0.79 . . . . 0.0 111.771 173.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.86 -172.3 42.18 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-N 118.537 0.608 . . . . 0.0 114.089 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.2 t -128.77 123.99 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.179 1.392 . . . . 0.0 109.891 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.3 3.49 25.2 Favored Glycine 0 CA--C 1.541 1.713 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -175.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 99.0 p -165.87 164.89 18.55 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.15 2.18 . . . . 0.0 111.42 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 93.1 m . . . . . 0 CA--C 1.54 0.575 0 C-N-CA 125.631 1.572 . . . . 0.0 110.611 171.942 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 CA--C 1.542 0.643 0 CA-C-O 121.989 0.899 . . . . 0.0 109.558 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.446 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.2 t-105 -55.07 -36.64 65.83 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.142 1.777 . . . . 0.0 112.185 169.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.88 -37.34 76.35 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.866 1.266 . . . . 0.0 112.195 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 p -89.47 -27.91 20.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.542 1.137 . . . . 0.0 113.521 174.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -52.05 -44.4 64.25 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.787 1.635 . . . . 0.0 113.067 174.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -56.02 -63.06 1.3 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -60.36 -20.01 57.83 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -70.11 -46.87 63.9 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.123 1.369 . . . . 0.0 113.311 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -153.04 23.65 0.56 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -176.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.4 mt -128.62 147.8 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 120.147 -1.596 . . . . 0.0 109.299 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -147.78 155.68 41.94 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 177.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.07 2.31 54.27 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.255 1.822 . . . . 0.0 112.814 167.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.1 t -160.18 114.41 2.22 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.185 1.794 . . . . 0.0 111.23 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.9 ttp-105 -66.47 103.21 1.0 Allowed 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.669 -1.27 . . . . 0.0 110.45 172.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -112.83 2.89 16.12 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.059 1.344 . . . . 0.0 113.45 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.419 HG22 ' H ' ' A' ' 67' ' ' CYS . 8.2 p -75.54 145.06 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.355 1.062 . . . . 0.0 112.398 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -130.32 8.08 5.03 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.112 1.765 . . . . 0.0 112.703 172.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.419 ' H ' HG22 ' A' ' 65' ' ' VAL . 21.4 m 48.37 50.85 16.04 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.895 2.478 . . . . 0.0 113.238 -176.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.43 -17.01 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.366 2.266 . . . . 0.0 113.202 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -110.26 -2.99 16.49 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.936 1.695 . . . . 0.0 113.767 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -63.98 -8.66 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.637 1.575 . . . . 0.0 113.913 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 ppp? -53.01 -22.51 5.83 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.8 t -98.07 -21.26 16.88 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.487 1.515 . . . . 0.0 113.995 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.1 p -87.35 -177.7 6.01 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 111.849 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -63.22 -20.53 65.51 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.832 -1.168 . . . . 0.0 113.646 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.79 21.81 3.39 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.569 1.948 . . . . 0.0 113.326 -175.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -63.6 -7.03 6.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 126.092 1.757 . . . . 0.0 114.663 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 66.0 t60 -64.7 -6.46 7.92 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.583 1.553 . . . . 0.0 114.653 -177.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.31 33.6 18.72 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.187 1.795 . . . . 0.0 114.476 -177.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 158.18 3.52 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.061 1.745 . . . . 0.0 113.926 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.04 -35.69 81.07 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.435 1.494 . . . . 0.0 114.877 -173.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -161.18 163.44 31.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.185 1.394 . . . . 0.0 112.774 165.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -131.63 166.18 22.02 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.979 0.912 . . . . 0.0 111.336 166.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.0 m -126.73 93.84 3.89 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.734 1.214 . . . . 0.0 109.404 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -77.95 122.64 25.78 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.259 0.624 . . . . 0.0 110.759 174.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -98.64 114.52 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.954 1.302 . . . . 0.0 107.848 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -87.02 86.1 7.29 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.386 0.612 . . . . 0.0 110.122 167.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.5 p -145.87 166.66 25.31 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.897 1.279 . . . . 0.0 112.205 168.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -73.29 164.47 60.73 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.406 1.082 . . . . 0.0 111.325 168.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.91 -23.19 25.83 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.747 2.298 . . . . 0.0 114.521 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -59.57 -58.49 19.09 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.61 1.164 . . . . 0.0 112.806 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.56 0.73 5.08 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.307 2.671 . . . . 0.0 114.926 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.6 t -103.3 -55.57 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 126.604 1.962 . . . . 0.0 109.82 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -43.07 85.11 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.208 -0.933 . . . . 0.0 112.769 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.64 -5.58 46.18 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -173.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.5 mt -53.49 -36.01 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.598 0.759 . . . . 0.0 110.58 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 p -111.5 158.44 19.16 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.805 1.242 . . . . 0.0 113.057 173.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -155.77 105.97 2.44 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.742 1.617 . . . . 0.0 110.579 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.35 5.62 86.94 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 123.984 0.802 . . . . 0.0 114.733 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.4 mt -77.45 116.53 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.676 1.19 . . . . 0.0 110.87 -178.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 7.5 mt -111.33 -12.52 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 126.768 2.027 . . . . 0.0 110.879 175.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.32 7.67 2.68 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 127.633 2.373 . . . . 0.0 116.095 -170.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.9 t 49.69 66.11 1.22 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.996 1.318 . . . . 0.0 113.276 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.1 tttt -159.37 157.46 30.39 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.352 1.461 . . . . 0.0 111.356 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -145.01 -169.11 3.11 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.576 -1.327 . . . . 0.0 112.067 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 16.8 t -125.74 143.2 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 126.127 1.771 . . . . 0.0 108.865 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.5 tp -50.78 141.91 12.32 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.559 1.143 . . . . 0.0 111.982 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.94 172.9 1.53 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 8.8 t -120.37 -28.85 4.93 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.799 1.24 . . . . 0.0 113.573 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.9 m -76.96 171.7 14.37 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.419 1.488 . . . . 0.0 111.845 173.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -123.04 110.4 15.29 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.118 0.967 . . . . 0.0 111.144 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -105.98 159.67 15.87 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.157 1.783 . . . . 0.0 110.245 -171.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.64 109.54 4.38 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.337 0.589 . . . . 0.0 110.513 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.03 123.18 44.81 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.283 1.433 . . . . 0.0 111.231 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.9 t -126.71 93.61 3.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.436 1.494 . . . . 0.0 110.686 -173.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.02 163.45 16.28 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.463 0.649 . . . . 0.0 110.329 173.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.96 138.77 19.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 158.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -126.74 134.6 50.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.931 1.292 . . . . 0.0 109.271 -175.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 29.2 t -60.9 149.93 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 123.556 0.742 . . . . 0.0 111.816 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -134.52 106.64 7.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.22 1.408 . . . . 0.0 110.933 171.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.253 1.262 0 C-N-CA 126.244 1.818 . . . . 0.0 112.602 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 CA--C 1.54 0.825 0 N-CA-C 111.521 -0.223 . . . . 0.0 111.521 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -145.84 179.28 7.57 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.61 2.364 . . . . 0.0 109.574 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -110.16 131.16 55.31 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.644 1.178 . . . . 0.0 110.733 -177.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.84 161.94 33.79 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.222 1.409 . . . . 0.0 111.924 -176.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -107.55 151.13 26.01 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.002 1.721 . . . . 0.0 112.764 177.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.74 113.36 16.75 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.555 1.942 . . . . 0.0 111.487 -172.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -139.55 109.45 6.36 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.39 1.476 . . . . 0.0 111.883 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -118.12 153.81 33.17 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.417 1.487 . . . . 0.0 111.637 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.0 m -156.21 172.19 18.89 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.17 1.788 . . . . 0.0 111.557 175.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 m -141.26 104.91 4.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.869 0.868 . . . . 0.0 110.569 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.415 HD21 ' HG ' ' A' ' 113' ' ' LEU . 0.4 OUTLIER -169.42 172.43 7.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.682 1.193 . . . . 0.0 113.664 -170.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.79 174.28 0.85 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.271 2.628 . . . . 0.0 114.397 167.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.01 147.06 32.21 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.682 1.993 . . . . 0.0 111.726 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 t -108.37 134.94 50.48 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.869 1.268 . . . . 0.0 111.404 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.3 m -141.79 -178.68 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.935 1.694 . . . . 0.0 111.707 -173.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.431 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.1 m -129.86 115.04 16.66 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.457 -0.777 . . . . 0.0 111.785 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.3 t -83.0 128.54 34.57 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.53 1.132 . . . . 0.0 111.254 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.23 112.16 8.42 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.682 1.193 . . . . 0.0 108.45 177.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 56.05 60.52 3.18 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.61 1.564 . . . . 0.0 112.968 -169.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.46 27.06 15.08 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.719 2.408 . . . . 0.0 114.751 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.17 133.8 5.45 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 109.519 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -75.86 105.12 2.02 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.809 3.006 . . . . 0.0 112.137 177.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 m -97.84 14.33 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.834 1.254 . . . . 0.0 111.997 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.431 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 24.7 t-80 -158.42 147.73 19.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.328 1.422 . . . . 0.0 113.025 -167.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -108.77 128.0 54.5 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.007 1.323 . . . . 0.0 111.009 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.4 t -93.66 -58.24 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.027 0.931 . . . . 0.0 110.97 174.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.77 -175.58 46.62 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.448 1.023 . . . . 0.0 112.652 -172.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.9 p -122.79 136.86 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.43 1.092 . . . . 0.0 111.84 -172.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.96 -5.36 3.67 Favored Glycine 0 CA--C 1.541 1.714 0 N-CA-C 116.2 1.24 . . . . 0.0 116.2 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -172.5 165.46 5.65 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 129.929 3.292 . . . . 0.0 109.527 -171.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 83.9 m . . . . . 0 CA--C 1.542 0.653 0 C-N-CA 125.042 1.337 . . . . 0.0 110.427 173.7 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 . . . . . 0 CA--C 1.543 0.711 0 CA-C-O 123.026 1.393 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -56.78 -36.99 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.186 2.194 . . . . 0.0 112.215 167.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.47 90.4 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.699 1.2 . . . . 0.0 111.587 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.6 p -82.93 -29.3 29.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.099 1.36 . . . . 0.0 113.532 174.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.56 -43.87 65.5 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.389 1.476 . . . . 0.0 112.699 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.12 -61.58 2.36 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.12 0.968 . . . . 0.0 110.536 173.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.66 -19.86 52.27 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -178.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -70.32 -48.44 56.52 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.764 1.626 . . . . 0.0 112.986 175.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -152.34 22.85 0.63 Allowed 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.8 mt -128.08 144.16 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 120.439 -1.413 . . . . 0.0 109.534 178.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.4 t -143.36 156.39 44.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 178.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -91.42 0.83 57.46 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.396 1.878 . . . . 0.0 112.487 167.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.3 t -162.8 112.29 1.38 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.338 1.855 . . . . 0.0 111.185 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.8 ttp-105 -68.0 107.34 2.65 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.545 -1.347 . . . . 0.0 110.673 173.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.47 1.57 13.68 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.142 1.377 . . . . 0.0 113.687 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.0 p -69.92 142.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.07 1.348 . . . . 0.0 112.516 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -130.96 12.16 5.17 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.268 1.827 . . . . 0.0 112.424 169.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.9 m 51.48 40.93 27.9 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.034 2.534 . . . . 0.0 113.152 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -153.25 -38.68 0.1 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.379 2.271 . . . . 0.0 111.362 -174.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -90.97 -8.3 49.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.369 1.067 . . . . 0.0 113.493 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.0 pt -62.15 -10.59 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.347 1.059 . . . . 0.0 113.721 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.83 -36.04 35.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.82 1.648 . . . . 0.0 113.451 166.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 96.0 p -87.3 -14.5 40.68 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 177.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.6 p -86.17 -178.84 6.61 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.221 1.408 . . . . 0.0 111.869 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -70.88 -12.43 61.54 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -85.93 10.02 15.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.031 2.132 . . . . 0.0 114.989 -176.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -67.49 -7.49 26.07 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 127.978 2.511 . . . . 0.0 114.605 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -61.79 0.54 0.35 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.237 2.615 . . . . 0.0 115.846 -174.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.6 t 56.15 30.96 17.38 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.233 1.813 . . . . 0.0 114.2 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.57 154.85 27.63 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.973 1.309 . . . . 0.0 112.616 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -63.96 -33.72 76.36 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.922 1.289 . . . . 0.0 114.322 -169.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.3 pttm -162.01 163.79 28.66 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.559 1.544 . . . . 0.0 111.901 166.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -132.94 159.31 40.34 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.574 0.749 . . . . 0.0 110.674 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.0 m -122.73 90.41 3.29 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.363 1.065 . . . . 0.0 110.332 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -77.42 119.93 21.72 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.638 0.775 . . . . 0.0 111.134 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.6 mt -96.08 112.92 29.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 125.645 1.578 . . . . 0.0 107.65 173.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -80.5 89.61 5.64 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.532 -0.73 . . . . 0.0 109.783 167.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.0 m -149.0 159.2 44.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.56 1.144 . . . . 0.0 112.981 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 25.8 mtt-85 -71.14 163.79 62.55 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 124.575 1.15 . . . . 0.0 111.115 164.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.59 -24.2 30.69 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 122.301 2.0 . . . . 0.0 114.201 176.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.61 -56.37 30.35 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 117.921 -1.038 . . . . 0.0 113.091 -175.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.79 -0.39 6.87 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.983 2.455 . . . . 0.0 114.826 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -102.9 -54.44 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.323 1.849 . . . . 0.0 109.749 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -45.53 78.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.209 -0.932 . . . . 0.0 112.848 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.56 35.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -172.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.09 -35.68 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 123.642 0.777 . . . . 0.0 110.599 169.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.3 p -111.07 157.42 20.0 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.864 1.266 . . . . 0.0 113.217 172.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -155.37 106.25 2.54 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.583 1.953 . . . . 0.0 109.875 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.6 3.24 86.49 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.39 0.995 . . . . 0.0 114.754 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.2 mt -76.12 116.05 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.706 1.202 . . . . 0.0 110.86 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 17.9 mt -105.54 -18.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 126.447 1.899 . . . . 0.0 110.807 173.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.12 8.87 1.12 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 128.095 2.558 . . . . 0.0 116.909 -166.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 8.7 t 50.7 62.08 2.89 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.895 1.225 . . . . 0.0 113.48 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -157.55 154.62 28.87 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 125.919 1.687 . . . . 0.0 111.242 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -138.09 -170.54 2.82 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.869 -1.145 . . . . 0.0 111.534 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.85 141.92 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 125.75 1.62 . . . . 0.0 108.524 173.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.6 tp -51.01 140.96 14.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.29 1.036 . . . . 0.0 111.72 169.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.58 170.85 2.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 122.583 1.183 . . . . 0.0 113.508 172.193 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.8 p -118.26 -30.89 5.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.567 1.947 . . . . 0.0 113.353 -176.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.5 m -80.52 171.08 15.5 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.711 1.604 . . . . 0.0 112.086 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -118.48 110.09 17.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.796 1.238 . . . . 0.0 111.164 -176.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -104.75 161.08 14.47 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.809 1.644 . . . . 0.0 110.374 -173.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -71.47 109.14 5.25 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.876 -0.515 . . . . 0.0 110.417 -179.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.415 ' HG ' HD21 ' A' ' 12' ' ' ASN . 0.3 OUTLIER -101.28 126.62 48.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.668 1.187 . . . . 0.0 112.003 -176.804 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 30.1 t -128.76 91.48 3.23 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.326 1.45 . . . . 0.0 109.855 -174.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -82.21 161.85 22.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.851 0.834 . . . . 0.0 110.407 169.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.58 128.73 11.15 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.04 -1.037 . . . . 0.0 109.484 157.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -116.96 136.87 52.61 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.406 1.083 . . . . 0.0 110.114 -173.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 20.6 t -60.5 147.35 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-O 121.451 0.643 . . . . 0.0 112.043 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.8 t -137.64 101.8 4.58 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.049 1.34 . . . . 0.0 111.269 172.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.0 p . . . . . 0 C--O 1.254 1.305 0 C-N-CA 126.591 1.956 . . . . 0.0 114.403 178.93 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo . . . . . 0 CA--C 1.539 0.76 0 N-CA-C 113.522 0.547 . . . . 0.0 113.522 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.68 -167.34 2.11 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.752 2.421 . . . . 0.0 109.217 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.12 149.41 42.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.736 1.214 . . . . 0.0 109.845 167.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -142.73 159.08 42.93 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.888 1.675 . . . . 0.0 110.213 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -99.11 157.21 16.51 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.481 1.112 . . . . 0.0 113.061 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.95 103.35 14.59 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.367 1.467 . . . . 0.0 111.093 -169.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -127.98 114.72 17.49 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.457 1.503 . . . . 0.0 111.118 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -130.86 147.67 52.54 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.05 1.74 . . . . 0.0 110.865 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.6 t -151.11 170.3 19.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.842 1.657 . . . . 0.0 110.987 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.4 m -139.7 100.86 4.06 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.479 -0.763 . . . . 0.0 110.768 173.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.93 176.74 9.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.833 1.253 . . . . 0.0 113.519 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.25 170.3 3.87 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.471 2.308 . . . . 0.0 113.608 171.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.9 p90 -141.15 142.18 34.08 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.122 1.769 . . . . 0.0 111.541 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.5 t -100.52 142.71 31.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.801 0.81 . . . . 0.0 111.413 174.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.483 HG23 HD22 ' A' ' 104' ' ' ASN . 16.8 m -147.24 -178.3 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 126.564 1.945 . . . . 0.0 110.983 -178.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -126.49 117.37 22.74 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.93 1.292 . . . . 0.0 111.532 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -87.1 133.0 33.66 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.658 0.783 . . . . 0.0 111.704 174.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -139.89 113.63 8.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.261 1.425 . . . . 0.0 108.501 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 59.47 56.7 3.6 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.402 1.481 . . . . 0.0 112.416 -169.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.12 24.81 13.57 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.629 2.372 . . . . 0.0 115.1 169.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.1 132.7 5.32 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.855 1.262 . . . . 0.0 109.639 -174.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.45 109.05 2.79 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.565 2.843 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.453 HG12 ' N ' ' A' ' 51' ' ' TRP . 4.0 m -108.52 18.2 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.692 1.997 . . . . 0.0 112.518 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -156.51 137.31 13.37 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.659 -1.276 . . . . 0.0 110.826 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -80.69 153.82 27.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.056 0.389 . . . . 0.0 110.452 167.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.9 -54.54 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.216 1.006 . . . . 0.0 112.155 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.45 -172.28 43.43 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.259 0.936 . . . . 0.0 114.677 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -125.91 129.04 72.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 125.413 1.485 . . . . 0.0 109.99 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.17 -4.58 4.56 Favored Glycine 0 CA--C 1.539 1.565 0 N-CA-C 116.664 1.426 . . . . 0.0 116.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.0 m -162.43 162.96 27.88 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.558 3.143 . . . . 0.0 109.869 -172.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 90.2 m . . . . . 0 CA--C 1.537 0.471 0 C-N-CA 125.212 1.405 . . . . 0.0 109.771 167.353 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 t0 . . . . . 0 CA--C 1.543 0.707 0 CA-C-O 122.547 1.165 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.453 ' N ' HG12 ' A' ' 24' ' ' VAL . 1.6 t-105 -56.67 -36.57 69.74 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.481 1.912 . . . . 0.0 112.357 168.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -45.08 89.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.034 1.334 . . . . 0.0 111.413 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.2 p -80.43 -30.94 37.64 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.854 1.262 . . . . 0.0 113.427 173.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -53.49 -44.14 68.79 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.318 1.447 . . . . 0.0 113.131 177.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -53.45 -61.58 2.21 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.147 0.979 . . . . 0.0 110.421 172.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -59.29 -20.06 51.29 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -72.66 -52.7 14.25 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.155 1.782 . . . . 0.0 113.856 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -133.14 7.88 3.99 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -175.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.4 mt -127.5 147.5 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 120.541 -1.349 . . . . 0.0 110.108 -172.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 12.5 t -143.34 154.99 44.31 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 174.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -91.18 0.52 57.51 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.194 1.798 . . . . 0.0 112.359 168.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.45 114.3 2.14 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.196 1.799 . . . . 0.0 111.192 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -67.93 103.39 1.47 Allowed 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.563 -1.336 . . . . 0.0 110.506 172.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -113.56 4.85 16.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.447 1.499 . . . . 0.0 113.046 177.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.6 t -79.74 142.55 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.434 1.093 . . . . 0.0 111.47 -176.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -128.71 9.66 5.95 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.032 1.733 . . . . 0.0 112.504 175.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 15.8 m 52.49 44.34 30.08 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.52 2.328 . . . . 0.0 113.043 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.7 -25.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.992 2.117 . . . . 0.0 113.245 -177.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -101.05 -5.05 26.28 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.751 1.22 . . . . 0.0 113.717 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.3 pt -61.41 -11.96 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.89 1.276 . . . . 0.0 114.005 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -57.37 -28.9 63.58 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.832 0.853 . . . . 0.0 112.923 167.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 t -83.82 1.26 43.92 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.01 1.724 . . . . 0.0 114.234 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.0 p -117.4 -177.02 3.13 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.611 1.565 . . . . 0.0 111.882 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -63.48 -17.85 63.16 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.14 -0.975 . . . . 0.0 113.539 171.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.77 11.71 25.99 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.204 1.802 . . . . 0.0 114.199 -170.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -63.3 -8.84 9.49 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.789 2.435 . . . . 0.0 115.313 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -62.28 -10.11 9.96 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.082 1.753 . . . . 0.0 114.759 -173.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 46.1 t 39.66 59.01 1.93 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.994 2.117 . . . . 0.0 113.234 -166.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.88 161.13 27.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.888 1.275 . . . . 0.0 111.743 162.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.88 -34.06 77.1 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.198 1.399 . . . . 0.0 114.381 -172.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.9 ptmt -160.02 157.05 28.02 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.7 1.6 . . . . 0.0 111.889 167.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -121.44 152.89 38.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.551 0.74 . . . . 0.0 109.42 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.5 m -112.36 98.13 7.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.017 1.327 . . . . 0.0 108.035 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -82.05 136.33 35.23 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.593 -0.692 . . . . 0.0 111.873 176.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.5 mt -109.12 109.7 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 125.942 1.697 . . . . 0.0 107.029 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.34 89.23 6.56 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.536 -0.727 . . . . 0.0 109.456 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 m -149.52 160.21 43.66 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.972 1.309 . . . . 0.0 112.687 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -70.16 163.42 61.86 Favored Pre-proline 0 N--CA 1.47 0.546 0 C-N-CA 124.326 1.05 . . . . 0.0 111.187 164.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.35 -23.55 27.97 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.312 2.008 . . . . 0.0 114.229 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.27 -57.7 23.92 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.088 -177.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.74 0.62 5.36 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.062 2.508 . . . . 0.0 114.855 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.27 -54.65 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.522 1.929 . . . . 0.0 109.748 176.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -46.01 76.29 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.129 -0.982 . . . . 0.0 112.745 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.44 -3.08 31.81 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -172.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.5 mt -53.19 -36.39 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 123.558 0.743 . . . . 0.0 110.403 168.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -107.96 159.0 16.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.084 0.954 . . . . 0.0 113.409 174.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.95 106.69 2.87 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.438 1.895 . . . . 0.0 109.779 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.53 5.08 90.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 124.301 0.953 . . . . 0.0 114.987 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.6 mt -75.85 116.11 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.646 1.179 . . . . 0.0 111.226 -176.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -110.82 -10.94 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 126.577 1.951 . . . . 0.0 111.008 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.14 3.76 5.22 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.447 2.299 . . . . 0.0 116.061 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 52.98 64.46 1.85 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.695 1.598 . . . . 0.0 112.717 -172.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -155.79 158.81 38.75 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.816 2.046 . . . . 0.0 110.968 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.483 HD22 HG23 ' A' ' 16' ' ' VAL . 6.9 t-20 -141.51 -167.56 2.45 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.715 -1.241 . . . . 0.0 111.469 163.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -124.51 145.7 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.331 1.452 . . . . 0.0 109.488 167.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -51.94 142.3 15.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.69 1.196 . . . . 0.0 111.944 168.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.22 172.77 2.28 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.7 t -122.66 -25.07 4.76 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.098 1.359 . . . . 0.0 113.931 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.3 m -80.52 170.93 15.69 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.76 1.224 . . . . 0.0 111.993 172.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -117.54 110.96 18.6 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.726 1.21 . . . . 0.0 111.348 -177.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -106.39 161.98 14.09 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.87 1.668 . . . . 0.0 110.603 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -71.57 108.01 4.73 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 121.745 -0.597 . . . . 0.0 110.297 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -99.89 119.21 37.85 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.594 1.558 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.1 t -122.43 97.33 5.41 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.038 1.335 . . . . 0.0 110.459 -171.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -93.52 163.03 13.73 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.512 0.725 . . . . 0.0 111.067 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.82 107.85 3.22 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.496 -0.753 . . . . 0.0 111.875 163.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -92.58 132.41 36.88 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.606 1.163 . . . . 0.0 111.215 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.0 t -56.72 148.07 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.509 1.523 . . . . 0.0 112.008 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.1 p -118.11 86.88 2.61 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.905 1.282 . . . . 0.0 111.684 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 32.2 p . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.833 1.653 . . . . 0.0 114.151 173.459 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 CA--C 1.539 0.749 0 CA-C-O 120.126 -0.031 . . . . 0.0 112.027 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 m -140.89 175.78 9.34 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.357 1.863 . . . . 0.0 110.417 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -97.42 130.07 44.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.522 1.129 . . . . 0.0 110.516 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -134.33 160.63 37.34 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.9 1.28 . . . . 0.0 112.205 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -109.57 153.14 24.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.536 1.934 . . . . 0.0 112.443 177.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.52 112.83 19.79 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.319 1.848 . . . . 0.0 111.727 -170.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -139.56 103.29 4.66 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.455 . . . . 0.0 112.275 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -124.32 149.82 46.15 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.316 1.046 . . . . 0.0 111.656 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.1 t -148.79 174.81 11.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.603 1.561 . . . . 0.0 111.9 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.1 m -140.45 102.87 4.43 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.032 0.933 . . . . 0.0 110.997 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.66 170.22 9.6 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.916 1.286 . . . . 0.0 113.45 -172.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.426 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -60.07 170.85 1.11 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.911 2.484 . . . . 0.0 113.617 168.551 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.22 147.65 35.19 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.369 1.868 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 t -106.1 141.91 36.68 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.063 0.945 . . . . 0.0 111.607 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.7 m -145.75 -179.4 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.175 1.79 . . . . 0.0 111.876 -175.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.3 m -127.17 118.55 24.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.144 0.978 . . . . 0.0 111.954 176.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.8 t -87.36 127.73 35.2 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.204 1.002 . . . . 0.0 111.794 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -135.58 114.72 12.3 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.057 1.343 . . . . 0.0 109.107 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 57.25 57.04 4.72 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 112.535 -172.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 64.33 26.66 13.67 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.468 2.307 . . . . 0.0 114.719 170.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.41 135.08 6.56 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.961 1.304 . . . . 0.0 109.548 -177.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.56 107.85 2.57 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.714 2.943 . . . . 0.0 112.564 177.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.9 m -100.76 6.46 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.495 1.518 . . . . 0.0 112.236 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -148.53 146.62 28.4 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.797 1.635 . . . . 0.0 112.592 -175.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -103.0 131.7 49.79 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.732 1.213 . . . . 0.0 111.108 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -104.52 -52.96 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.146 0.978 . . . . 0.0 112.084 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.62 -172.58 44.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 119.098 0.863 . . . . 0.0 114.924 -173.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.8 t -123.69 124.01 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.724 1.61 . . . . 0.0 110.354 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 65.78 3.62 16.41 Favored Glycine 0 CA--C 1.54 1.594 0 N-CA-C 115.864 1.105 . . . . 0.0 115.864 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.5 m -169.88 163.75 9.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 128.62 2.768 . . . . 0.0 110.382 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m . . . . . 0 CA--C 1.542 0.668 0 C-N-CA 125.574 1.55 . . . . 0.0 110.532 172.987 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 p30 . . . . . 0 CA--C 1.54 0.574 0 CA-C-O 123.429 1.585 . . . . 0.0 113.092 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -57.18 -33.7 67.72 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.181 2.192 . . . . 0.0 113.787 174.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.96 -46.13 89.19 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.097 -1.002 . . . . 0.0 110.62 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.2 p -76.9 -26.53 54.24 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 173.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -52.81 -46.01 67.51 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.57 1.548 . . . . 0.0 112.46 175.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -56.96 -60.66 3.25 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.072 0.949 . . . . 0.0 110.791 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.99 -24.94 60.22 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.37 -54.58 22.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.649 1.58 . . . . 0.0 114.047 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -146.9 20.22 1.27 Allowed 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.3 mt -126.72 150.19 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.063 1.345 . . . . 0.0 109.701 173.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 t -141.68 151.9 43.42 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -84.03 -3.71 58.22 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.604 1.562 . . . . 0.0 112.909 170.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.0 t -162.26 118.26 1.97 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.255 1.822 . . . . 0.0 110.991 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.9 ttp-105 -69.0 100.31 1.2 Allowed 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.515 -1.365 . . . . 0.0 111.389 174.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -107.52 4.18 25.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.568 1.547 . . . . 0.0 113.171 173.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.5 t -75.45 138.72 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.327 1.451 . . . . 0.0 111.426 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -126.68 4.56 6.74 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.794 1.638 . . . . 0.0 113.155 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.6 m 54.16 35.78 23.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.98 2.112 . . . . 0.0 113.321 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -153.52 -27.38 0.14 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.742 2.417 . . . . 0.0 112.513 -172.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -115.06 3.88 14.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.146 1.778 . . . . 0.0 114.27 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.9 pt -63.57 -8.33 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.219 1.407 . . . . 0.0 113.617 174.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.9 ttt -54.1 -28.15 37.55 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.955 1.302 . . . . 0.0 112.752 162.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 t -92.98 -0.7 57.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.153 1.781 . . . . 0.0 114.215 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.8 p -114.76 -175.59 2.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.385 1.474 . . . . 0.0 111.4 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -64.15 -15.91 60.78 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 120.935 -1.103 . . . . 0.0 113.711 176.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -100.28 17.72 20.66 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.167 1.787 . . . . 0.0 114.24 -164.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -68.85 -7.64 36.31 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 128.984 2.914 . . . . 0.0 114.682 -173.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -63.28 2.26 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 128.179 2.592 . . . . 0.0 115.817 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.2 t 56.79 27.92 13.57 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.263 1.825 . . . . 0.0 114.117 -176.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 154.93 17.68 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.131 1.372 . . . . 0.0 112.207 177.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.7 -33.97 77.21 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.9 ptmm? -161.37 160.03 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.905 1.682 . . . . 0.0 112.676 167.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -131.03 125.37 33.09 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.377 1.071 . . . . 0.0 109.766 163.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -87.64 95.2 9.97 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.546 1.138 . . . . 0.0 109.964 171.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -82.5 127.83 33.7 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.878 -0.514 . . . . 0.0 111.455 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 61.8 mt -97.93 114.92 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 125.015 1.326 . . . . 0.0 107.845 172.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.26 87.45 7.14 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.46 0.704 . . . . 0.0 110.203 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.2 m -144.94 165.63 27.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.739 2.015 . . . . 0.0 112.549 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -74.22 164.28 62.35 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 124.339 1.056 . . . . 0.0 110.761 161.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.28 -23.98 17.2 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.509 2.139 . . . . 0.0 114.147 174.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.21 -55.59 44.73 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 124.419 1.088 . . . . 0.0 113.466 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.46 -1.51 9.18 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 123.107 2.538 . . . . 0.0 114.575 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.55 -54.24 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 126.249 1.819 . . . . 0.0 109.398 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -45.33 81.22 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.25 -0.906 . . . . 0.0 112.912 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.85 -3.63 36.28 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -171.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 52.8 mt -53.93 -35.34 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 123.609 0.764 . . . . 0.0 110.665 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 21.0 p -111.39 158.43 19.08 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.245 1.418 . . . . 0.0 113.118 173.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -155.56 112.99 3.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.978 1.711 . . . . 0.0 110.402 175.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.09 2.95 90.57 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.666 1.127 . . . . 0.0 114.97 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 50.6 mt -77.33 118.53 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.967 1.307 . . . . 0.0 111.063 -176.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.0 mt -111.15 -13.1 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.595 1.958 . . . . 0.0 111.046 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.2 1.96 6.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.389 2.276 . . . . 0.0 116.355 -168.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.66 68.47 0.82 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.594 1.558 . . . . 0.0 112.431 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -158.06 149.36 21.22 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.361 1.864 . . . . 0.0 110.516 -176.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -140.4 -168.1 2.48 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.643 -1.286 . . . . 0.0 111.364 164.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -126.36 149.38 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 125.636 1.575 . . . . 0.0 109.729 168.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.4 tp -53.47 142.39 22.28 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.75 1.22 . . . . 0.0 111.644 168.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.52 173.24 1.7 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 173.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.6 t -124.9 -23.38 4.29 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.755 1.222 . . . . 0.0 114.177 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.9 m -79.59 170.52 16.43 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.38 1.072 . . . . 0.0 111.498 169.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -124.73 104.94 8.93 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.139 0.976 . . . . 0.0 111.522 -173.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -101.65 163.11 12.43 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.058 2.143 . . . . 0.0 110.798 -171.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -75.6 105.89 6.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.597 -0.689 . . . . 0.0 110.669 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.81 119.47 35.34 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.834 1.253 . . . . 0.0 111.667 178.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.8 t -119.64 87.63 2.78 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 126.041 1.736 . . . . 0.0 110.001 -171.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.9 163.94 21.9 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.325 1.06 . . . . 0.0 111.318 168.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -154.99 124.45 6.41 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.67 1.588 . . . . 0.0 108.689 162.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -111.04 139.39 46.44 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.357 1.063 . . . . 0.0 109.909 -175.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 16.0 t -60.99 148.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.754 0.822 . . . . 0.0 111.89 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.2 t -140.48 86.05 2.04 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-O 122.694 1.235 . . . . 0.0 111.867 173.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.255 1.389 0 C-N-CA 125.745 1.618 . . . . 0.0 111.993 174.664 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo . . . . . 0 CA--C 1.538 0.691 0 N-CA-C 113.165 0.409 . . . . 0.0 113.165 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -141.11 167.49 22.06 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.701 2.4 . . . . 0.0 109.204 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.543 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.3 mmpt? -93.43 143.86 25.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.533 0.733 . . . . 0.0 111.174 172.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -138.25 161.64 36.36 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.557 1.543 . . . . 0.0 111.473 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -97.43 154.23 17.61 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 127.297 2.239 . . . . 0.0 110.863 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.2 tp -79.83 128.47 33.48 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.964 0.906 . . . . 0.0 111.062 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.9 tptt -148.66 97.08 2.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.519 1.528 . . . . 0.0 111.771 173.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -110.72 142.52 42.53 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.819 1.247 . . . . 0.0 110.931 175.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 38.7 m -153.42 172.69 16.71 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.971 1.708 . . . . 0.0 111.066 -176.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 m -145.44 101.57 3.6 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.969 -1.082 . . . . 0.0 110.885 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.28 175.12 8.51 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.034 1.333 . . . . 0.0 113.316 -176.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.12 170.7 3.44 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 128.215 2.606 . . . . 0.0 113.801 171.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -140.06 142.56 36.15 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.116 1.767 . . . . 0.0 111.802 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -101.62 141.82 33.91 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.855 0.862 . . . . 0.0 111.405 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.516 HG23 HD22 ' A' ' 104' ' ' ASN . 15.2 m -146.75 -178.95 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 126.32 1.848 . . . . 0.0 111.282 -175.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.2 m -125.68 117.92 24.53 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.436 1.094 . . . . 0.0 111.194 174.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -84.4 134.57 34.47 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.564 0.697 . . . . 0.0 111.336 172.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.75 114.62 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.421 1.489 . . . . 0.0 108.403 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 57.98 55.78 5.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.668 1.187 . . . . 0.0 112.504 -171.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.9 24.43 11.23 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 127.655 2.382 . . . . 0.0 115.189 169.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.16 133.41 6.14 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 124.914 1.285 . . . . 0.0 109.421 -176.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.04 103.39 1.73 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.71 2.94 . . . . 0.0 112.354 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 m -98.41 10.08 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.178 1.391 . . . . 0.0 112.288 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -150.62 143.66 24.75 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.851 1.659 . . . . 0.0 112.295 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -98.2 137.12 37.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.217 1.007 . . . . 0.0 111.29 174.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -110.86 -53.77 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.97 0.908 . . . . 0.0 111.754 178.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.38 -171.12 42.91 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-N 118.782 0.719 . . . . 0.0 114.227 -174.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.14 129.45 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 0.0 109.799 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.16 0.21 7.19 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -168.58 164.27 12.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.577 2.351 . . . . 0.0 110.645 -174.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.5 m . . . . . 0 CA--C 1.543 0.692 0 C-N-CA 125.994 1.718 . . . . 0.0 111.419 173.968 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 p30 . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 123.107 1.432 . . . . 0.0 112.94 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -59.44 -34.05 72.03 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.436 1.895 . . . . 0.0 113.715 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.09 -44.73 96.04 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.982 -1.073 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 p -76.18 -28.02 57.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.05 1.34 . . . . 0.0 113.965 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -52.44 -45.19 65.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.65 1.568 . . . . 0.0 112.749 176.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.58 -62.81 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.447 1.099 . . . . 0.0 110.629 173.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -60.55 -19.78 58.37 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.67 -51.15 44.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.176 1.79 . . . . 0.0 113.769 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -151.24 23.4 0.73 Allowed 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -174.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -127.99 148.9 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 125.493 1.517 . . . . 0.0 109.367 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -146.74 156.95 43.55 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -92.74 2.7 56.6 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.227 1.811 . . . . 0.0 112.403 169.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.03 114.06 2.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.216 1.806 . . . . 0.0 111.089 172.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.6 ttp-105 -66.58 106.33 1.76 Allowed 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.675 -1.266 . . . . 0.0 110.643 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -116.05 4.16 13.68 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.353 1.461 . . . . 0.0 113.346 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.3 p -75.91 145.69 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.392 1.077 . . . . 0.0 112.978 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -130.88 6.85 4.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.24 1.816 . . . . 0.0 112.943 173.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 m 50.78 47.7 24.08 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 127.589 2.355 . . . . 0.0 113.53 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.12 -28.23 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.651 2.38 . . . . 0.0 112.323 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -103.65 0.44 30.7 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.183 1.393 . . . . 0.0 113.563 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.7 pt -62.81 -11.53 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.095 1.358 . . . . 0.0 113.706 177.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -54.67 -31.3 57.5 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.238 1.015 . . . . 0.0 112.899 165.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.1 m -82.39 1.71 35.95 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.219 1.408 . . . . 0.0 114.527 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.7 p -118.0 -176.12 2.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.895 1.678 . . . . 0.0 111.715 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -64.86 -19.12 65.72 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.21 13.08 12.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.364 1.866 . . . . 0.0 114.208 -172.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -66.31 -9.74 35.95 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.032 2.133 . . . . 0.0 114.82 -172.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -7.75 3.78 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.625 2.37 . . . . 0.0 115.554 -173.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.0 t 39.11 58.69 1.8 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 126.793 2.037 . . . . 0.0 113.635 -168.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.403 ' HG3' ' H ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER -68.91 160.98 29.72 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.136 1.374 . . . . 0.0 112.025 162.445 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.84 -31.27 71.77 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -170.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -160.12 156.23 26.42 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.402 1.481 . . . . 0.0 111.959 169.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -132.1 112.68 12.53 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.115 0.966 . . . . 0.0 111.032 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.8 m -83.43 96.71 8.64 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.442 0.697 . . . . 0.0 110.439 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -80.64 132.87 35.65 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 122.835 0.454 . . . . 0.0 111.233 173.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 78.1 mt -104.95 113.54 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.196 1.398 . . . . 0.0 107.661 171.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -85.6 86.43 7.37 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.313 0.578 . . . . 0.0 109.614 167.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -150.39 167.42 27.14 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.95 1.3 . . . . 0.0 112.518 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -79.85 160.68 68.53 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 126.059 1.744 . . . . 0.0 110.536 175.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -70.54 -22.84 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.076 1.851 . . . . 0.0 114.593 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.32 -57.14 21.7 Favored Pre-proline 0 N--CA 1.473 0.721 0 C-N-CA 124.214 1.006 . . . . 0.0 112.977 -178.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.04 -0.27 5.34 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.212 2.608 . . . . 0.0 114.897 178.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.6 t -101.33 -54.9 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.584 1.953 . . . . 0.0 109.736 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -45.78 78.55 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.288 -0.883 . . . . 0.0 112.924 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.53 -2.96 31.46 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.4 mt -53.41 -35.87 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.618 0.767 . . . . 0.0 110.486 169.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.1 p -109.56 158.93 17.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.415 1.086 . . . . 0.0 113.222 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -155.57 103.27 2.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.114 1.766 . . . . 0.0 109.899 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.93 4.57 84.51 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.389 0.995 . . . . 0.0 114.807 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.2 mt -74.93 114.76 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.599 1.2 . . . . 0.0 111.113 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.93 -15.13 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 126.717 2.007 . . . . 0.0 110.68 171.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.54 23.92 0.21 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.666 2.787 . . . . 0.0 115.45 -171.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.2 p 41.28 64.63 0.97 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.334 1.854 . . . . 0.0 114.069 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.6 158.7 40.13 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.709 1.603 . . . . 0.0 111.215 -177.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.516 HD22 HG23 ' A' ' 16' ' ' VAL . 5.7 t-20 -142.34 -170.63 3.22 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.738 -1.226 . . . . 0.0 111.796 160.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -124.09 139.58 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.541 1.537 . . . . 0.0 108.705 171.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.85 140.17 12.22 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.551 1.14 . . . . 0.0 111.906 170.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.4 172.28 1.59 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.1 t -119.55 -29.65 5.04 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.969 1.308 . . . . 0.0 113.366 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.7 m -77.14 169.58 18.08 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.305 1.442 . . . . 0.0 112.171 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -117.83 107.39 14.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.442 1.097 . . . . 0.0 111.22 -177.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -100.55 161.81 13.35 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.729 1.612 . . . . 0.0 110.595 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -72.1 106.38 4.32 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.285 0.564 . . . . 0.0 110.294 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -97.63 122.19 40.42 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.498 1.519 . . . . 0.0 110.889 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 37.8 t -126.14 93.63 3.87 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.512 1.525 . . . . 0.0 109.312 -173.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -93.69 163.09 13.68 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.286 1.041 . . . . 0.0 111.057 172.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -148.51 134.8 19.44 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.54 1.536 . . . . 0.0 108.429 164.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.3 m-80 -118.27 127.94 54.2 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.512 1.125 . . . . 0.0 110.391 -175.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.27 144.85 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.657 0.783 . . . . 0.0 111.874 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -135.31 103.51 5.53 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.919 1.287 . . . . 0.0 111.197 173.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.255 1.351 0 C-N-CA 126.238 1.815 . . . . 0.0 112.394 179.662 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo . . . . . 0 CA--C 1.537 0.643 0 CA-C-O 120.694 0.206 . . . . 0.0 112.239 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.79 168.82 18.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.466 1.906 . . . . 0.0 110.207 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -88.79 127.96 35.63 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.653 1.181 . . . . 0.0 111.161 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -138.79 155.32 48.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.422 1.089 . . . . 0.0 113.336 179.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -93.77 155.41 17.24 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.254 2.222 . . . . 0.0 111.725 179.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.39 114.5 21.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.678 1.591 . . . . 0.0 111.675 176.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -139.34 114.87 9.89 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.582 1.553 . . . . 0.0 111.338 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -132.74 147.39 52.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.742 1.617 . . . . 0.0 111.179 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.8 m -156.86 171.86 19.67 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.535 1.934 . . . . 0.0 111.683 -177.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -142.38 105.02 4.51 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.548 -0.72 . . . . 0.0 111.103 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.68 173.98 5.16 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.051 1.34 . . . . 0.0 113.397 -170.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.9 173.43 0.77 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.596 2.358 . . . . 0.0 114.273 168.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.9 p90 -144.14 145.34 32.05 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.022 2.129 . . . . 0.0 111.441 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 t -107.17 143.94 34.62 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.915 0.864 . . . . 0.0 112.441 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.533 HG23 HD22 ' A' ' 104' ' ' ASN . 16.0 m -149.22 -179.39 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 126.621 1.968 . . . . 0.0 111.62 -171.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.7 m -126.36 120.53 30.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.148 0.979 . . . . 0.0 111.336 174.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.31 132.69 34.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.961 0.905 . . . . 0.0 111.277 174.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -136.85 121.72 18.76 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.229 1.412 . . . . 0.0 108.53 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 55.43 53.76 9.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.614 1.165 . . . . 0.0 112.46 -171.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 64.91 26.45 12.82 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.379 2.271 . . . . 0.0 115.04 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -156.54 132.78 6.0 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.806 1.243 . . . . 0.0 109.587 -176.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -76.06 105.37 2.07 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.735 2.957 . . . . 0.0 112.283 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.42 HG12 ' N ' ' A' ' 51' ' ' TRP . 7.3 m -104.61 15.83 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.688 1.595 . . . . 0.0 112.397 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.417 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 16.5 t-80 -154.96 145.74 22.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.696 1.135 . . . . 0.0 112.114 -176.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -102.15 137.53 40.29 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.534 1.134 . . . . 0.0 111.356 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 43.9 t -111.87 -52.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.926 0.89 . . . . 0.0 112.539 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.23 -172.43 43.45 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-N 119.194 0.906 . . . . 0.0 115.198 -171.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t -128.19 126.82 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.976 1.71 . . . . 0.0 110.786 -170.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.51 -13.12 5.2 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.746 1.165 . . . . 0.0 115.753 176.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.6 m -163.35 169.61 18.78 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 130.926 3.691 . . . . 0.0 108.469 -164.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 CA--C 1.54 0.569 0 C-N-CA 124.045 0.938 . . . . 0.0 111.383 179.221 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 . . . . . 0 CA--C 1.544 0.73 0 CA-C-O 122.677 1.227 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.42 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.7 t-105 -56.65 -37.08 70.27 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.477 2.311 . . . . 0.0 112.698 170.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -42.63 91.24 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 0.0 111.357 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.3 p -85.4 -27.14 25.99 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.119 1.368 . . . . 0.0 113.941 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -51.48 -41.68 61.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.283 1.433 . . . . 0.0 112.682 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -57.56 -64.34 0.93 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.026 0.931 . . . . 0.0 110.614 172.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -59.87 -21.0 60.41 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -65.77 -51.44 59.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.307 1.843 . . . . 0.0 112.572 175.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -150.46 22.21 0.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -174.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -128.91 144.67 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.196 -1.565 . . . . 0.0 109.517 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -143.06 153.46 42.96 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -84.38 -0.45 52.72 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.733 1.613 . . . . 0.0 112.714 169.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.7 t -164.09 112.18 1.15 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.259 1.824 . . . . 0.0 111.405 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.6 ttp85 -67.99 104.53 1.76 Allowed 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.429 -1.42 . . . . 0.0 110.583 172.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -116.84 3.31 12.91 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.457 1.503 . . . . 0.0 113.193 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.444 HG22 ' H ' ' A' ' 67' ' ' CYS . 10.5 p -73.8 147.4 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.042 1.337 . . . . 0.0 112.573 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -134.6 9.18 3.64 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.92 1.688 . . . . 0.0 112.531 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.444 ' H ' HG22 ' A' ' 65' ' ' VAL . 35.2 m 51.47 38.68 22.7 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.444 2.298 . . . . 0.0 113.193 -175.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -145.33 -36.17 0.3 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 128.386 2.674 . . . . 0.0 112.655 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -100.08 -4.33 30.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.666 1.586 . . . . 0.0 113.633 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -60.27 -14.59 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.546 1.138 . . . . 0.0 113.637 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.8 ttt -53.91 -26.63 26.1 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.938 1.695 . . . . 0.0 113.568 168.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.0 t -103.49 1.98 33.05 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.95 1.7 . . . . 0.0 113.849 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -103.31 -174.2 2.49 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 125.494 1.518 . . . . 0.0 111.552 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -63.25 -20.62 65.61 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.129 -0.982 . . . . 0.0 113.582 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.38 12.32 27.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.77 1.628 . . . . 0.0 114.059 -166.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -65.2 -5.11 6.09 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.516 2.726 . . . . 0.0 114.914 -176.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.5 t60 -61.27 -4.8 1.31 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.976 2.11 . . . . 0.0 115.069 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.4 t 56.55 33.76 23.21 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.327 1.851 . . . . 0.0 113.77 -177.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 160.08 14.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.377 1.471 . . . . 0.0 112.351 176.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -67.04 -36.45 82.1 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.562 1.145 . . . . 0.0 113.754 -172.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -159.66 159.62 33.24 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.049 1.34 . . . . 0.0 111.841 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -140.52 127.98 21.35 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.383 0.673 . . . . 0.0 110.433 167.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.0 m -92.41 91.95 7.88 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.685 176.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -75.63 125.29 28.74 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.657 0.783 . . . . 0.0 111.043 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 91.5 mt -103.41 115.8 46.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 125.39 1.476 . . . . 0.0 107.661 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -89.49 86.17 6.7 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.67 0.748 . . . . 0.0 109.749 169.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.0 p -146.46 166.59 25.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.092 1.757 . . . . 0.0 111.959 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 29.1 mmm-85 -78.71 161.09 70.52 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 125.092 1.357 . . . . 0.0 110.422 172.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.93 -21.23 32.99 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 122.102 1.868 . . . . 0.0 114.436 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.12 -57.0 23.05 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-O 117.983 -1.008 . . . . 0.0 112.575 -178.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.22 -0.25 5.44 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.25 2.633 . . . . 0.0 115.168 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -100.96 -55.24 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 126.07 1.748 . . . . 0.0 109.833 174.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.09 -44.4 80.11 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.159 -0.963 . . . . 0.0 112.989 -179.204 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.47 -2.96 31.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -173.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.36 -35.77 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.668 0.787 . . . . 0.0 110.483 169.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.3 p -109.67 158.54 17.97 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.414 1.086 . . . . 0.0 113.308 174.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -153.26 107.72 3.12 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.318 1.847 . . . . 0.0 109.833 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.6 5.23 90.06 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.337 0.97 . . . . 0.0 114.786 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.4 mt -75.73 114.74 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.564 1.146 . . . . 0.0 111.028 -177.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.1 mt -109.58 -12.62 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 126.685 1.994 . . . . 0.0 110.861 172.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.99 5.45 3.31 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.665 2.386 . . . . 0.0 116.143 -171.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.4 t 51.39 65.73 1.4 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.58 1.552 . . . . 0.0 112.904 -172.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -154.44 157.93 39.2 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.214 1.806 . . . . 0.0 111.076 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.533 HD22 HG23 ' A' ' 16' ' ' VAL . 6.2 t-20 -142.02 -169.98 3.05 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.783 -1.198 . . . . 0.0 111.86 163.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.5 t -124.36 141.87 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.681 1.592 . . . . 0.0 108.7 170.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -51.02 142.31 12.32 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.811 1.245 . . . . 0.0 111.742 169.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.54 172.24 2.17 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.0 t -120.26 -26.28 5.5 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.199 1.399 . . . . 0.0 113.519 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.0 m -81.06 171.01 15.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.492 1.517 . . . . 0.0 112.006 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -116.54 110.56 18.73 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.504 1.122 . . . . 0.0 111.34 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -106.38 158.31 16.98 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.818 1.647 . . . . 0.0 109.893 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.45 110.75 5.53 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.634 -0.666 . . . . 0.0 110.719 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -101.03 125.51 47.65 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.635 1.574 . . . . 0.0 111.766 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 39.0 t -130.8 91.7 3.11 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.386 1.475 . . . . 0.0 110.796 -172.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -85.5 163.32 18.5 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.959 0.885 . . . . 0.0 111.87 170.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -146.05 140.59 26.9 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 158.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -128.82 129.35 45.49 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.983 0.913 . . . . 0.0 109.907 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.83 146.63 8.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.87 0.868 . . . . 0.0 112.687 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.02 77.77 1.68 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 122.926 1.346 . . . . 0.0 111.863 174.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 75.7 m . . . . . 0 C--O 1.252 1.221 0 C-N-CA 127.44 2.296 . . . . 0.0 112.697 177.708 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo . . . . . 0 CA--C 1.545 1.064 0 N-CA-C 113.642 0.593 . . . . 0.0 113.642 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 86.9 m -128.53 174.84 9.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 127.224 2.21 . . . . 0.0 109.482 169.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -105.48 145.19 31.21 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.173 1.389 . . . . 0.0 108.625 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.78 158.51 43.85 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.942 1.297 . . . . 0.0 110.923 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -100.11 159.42 15.12 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 113.22 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.57 105.7 17.03 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.654 1.582 . . . . 0.0 111.362 -169.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -131.96 112.47 12.43 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.638 1.575 . . . . 0.0 111.051 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -131.44 141.91 49.91 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.916 1.687 . . . . 0.0 111.016 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.4 m -146.74 168.06 22.31 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.807 1.643 . . . . 0.0 111.348 -175.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -141.15 103.65 4.48 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.572 -0.705 . . . . 0.0 111.296 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.0 173.52 5.06 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.99 1.316 . . . . 0.0 113.068 -169.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.25 171.77 0.96 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.489 2.316 . . . . 0.0 113.841 167.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -142.64 147.7 36.21 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.783 2.033 . . . . 0.0 111.197 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.3 t -107.58 141.34 39.19 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.896 0.879 . . . . 0.0 111.341 176.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.488 HG23 HD22 ' A' ' 104' ' ' ASN . 15.8 m -146.86 -178.92 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 126.35 1.86 . . . . 0.0 111.25 -175.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.7 m -126.77 119.24 26.39 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 121.257 -0.902 . . . . 0.0 111.45 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.2 132.4 34.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.96 0.904 . . . . 0.0 111.668 175.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -140.13 115.67 10.06 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.038 1.335 . . . . 0.0 108.796 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 58.68 56.37 4.24 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.273 1.429 . . . . 0.0 112.397 -169.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 64.54 24.3 13.04 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.737 2.415 . . . . 0.0 115.06 169.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.86 132.71 5.43 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.827 1.251 . . . . 0.0 109.444 -173.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -76.28 106.45 2.26 Favored 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 123.794 2.996 . . . . 0.0 112.189 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.44 HG12 ' N ' ' A' ' 51' ' ' TRP . 5.9 m -101.38 14.33 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.329 1.452 . . . . 0.0 111.85 -178.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 20.8 t-80 -158.95 141.8 14.39 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.037 1.29 . . . . 0.0 112.651 -167.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -92.67 146.95 23.27 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.613 0.765 . . . . 0.0 112.096 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.9 t -120.1 -55.7 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 124.146 0.978 . . . . 0.0 112.436 172.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.39 -173.36 42.83 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 119.297 0.953 . . . . 0.0 115.388 -170.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -127.0 122.99 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.97 1.708 . . . . 0.0 110.235 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.54 -0.05 7.44 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 115.959 1.143 . . . . 0.0 115.959 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.1 m -170.29 165.66 8.86 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 129.28 3.032 . . . . 0.0 110.289 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.9 m . . . . . 0 CA--C 1.542 0.673 0 C-N-CA 125.742 1.617 . . . . 0.0 110.839 174.731 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 t0 . . . . . 0 CA--C 1.543 0.695 0 CA-C-O 122.528 1.156 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.44 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.5 t-105 -53.74 -36.56 62.44 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 127.079 2.152 . . . . 0.0 112.274 168.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.32 -45.44 93.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.809 0.844 . . . . 0.0 111.015 177.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.9 p -72.01 -35.61 69.47 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -54.14 -44.11 71.13 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.463 1.505 . . . . 0.0 113.065 -177.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.14 -62.04 1.91 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.367 1.067 . . . . 0.0 110.725 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.403 ' H ' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -61.65 -20.29 63.24 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -179.215 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -68.62 -54.78 14.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 113.437 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -133.17 6.7 3.9 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -172.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.12 147.49 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 O-C-N 120.387 -1.446 . . . . 0.0 110.107 -173.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -142.49 153.26 43.49 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -81.55 -5.54 58.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.857 1.663 . . . . 0.0 112.882 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.1 t -165.14 121.22 1.41 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.633 1.973 . . . . 0.0 110.569 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.0 ttp-105 -66.44 104.52 1.26 Allowed 'General case' 0 N--CA 1.473 0.711 0 O-C-N 120.488 -1.383 . . . . 0.0 110.8 174.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -113.97 2.79 15.13 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.219 1.408 . . . . 0.0 113.455 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.454 HG22 ' H ' ' A' ' 67' ' ' CYS . 9.7 p -74.7 146.03 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.115 0.966 . . . . 0.0 112.235 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -130.4 7.36 4.93 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.891 1.676 . . . . 0.0 112.742 171.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.454 ' H ' HG22 ' A' ' 65' ' ' VAL . 18.6 m 52.26 42.99 31.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.602 2.361 . . . . 0.0 113.023 -177.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -155.77 -25.61 0.11 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.405 2.282 . . . . 0.0 113.349 -178.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -106.32 -4.21 20.29 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.058 1.343 . . . . 0.0 113.94 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 pt -60.33 -12.29 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.006 1.322 . . . . 0.0 113.885 -179.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -24.23 28.36 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 167.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 69.8 m -91.29 -5.37 54.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.363 1.465 . . . . 0.0 114.356 174.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.4 p -103.43 -176.7 3.16 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.497 1.519 . . . . 0.0 111.927 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -64.98 -19.49 66.01 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.173 -0.954 . . . . 0.0 113.465 171.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -93.64 20.12 7.82 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.008 2.123 . . . . 0.0 113.471 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -63.94 -9.26 14.52 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.022 2.129 . . . . 0.0 114.61 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -63.55 -2.33 1.59 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.853 2.461 . . . . 0.0 115.342 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 57.82 21.03 7.08 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.149 1.78 . . . . 0.0 114.755 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.67 157.81 11.21 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.79 2.036 . . . . 0.0 114.485 -173.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.02 -39.46 78.4 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.081 1.752 . . . . 0.0 114.694 -168.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -159.4 157.49 30.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.161 1.384 . . . . 0.0 112.525 167.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -135.1 128.67 32.63 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.339 1.056 . . . . 0.0 110.532 167.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.1 m -88.77 99.12 12.11 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.989 0.916 . . . . 0.0 109.659 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -82.5 135.05 35.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.321 -0.862 . . . . 0.0 112.337 174.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 66.4 mt -107.73 111.17 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 125.702 1.601 . . . . 0.0 107.676 174.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.98 86.67 7.35 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.56 -0.713 . . . . 0.0 109.845 169.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 t -152.32 175.0 13.13 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.244 1.018 . . . . 0.0 113.338 168.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -74.61 162.68 72.62 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 128.03 2.532 . . . . 0.0 110.678 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.43 -24.94 18.7 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 122.267 1.978 . . . . 0.0 114.02 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.82 -55.53 37.36 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.397 1.079 . . . . 0.0 113.07 -176.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.26 -1.26 7.75 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.829 2.353 . . . . 0.0 114.724 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.7 t -99.89 -54.61 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.152 1.781 . . . . 0.0 109.6 174.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.403 ' HE3' ' NE1' ' A' ' 51' ' ' TRP . 0.0 OUTLIER -66.54 -46.06 77.39 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.217 -0.927 . . . . 0.0 112.983 -179.184 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.56 -2.99 31.69 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -171.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.0 mt -53.25 -35.89 24.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.793 0.837 . . . . 0.0 110.599 169.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -110.34 158.97 17.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 0.0 113.204 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -156.41 104.34 2.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.18 1.792 . . . . 0.0 109.932 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.92 3.15 85.81 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 124.465 1.031 . . . . 0.0 114.949 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.0 mt -74.82 115.48 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.542 1.171 . . . . 0.0 111.238 -177.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -108.81 -13.1 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 126.383 1.873 . . . . 0.0 110.962 171.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.06 4.1 3.82 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.517 2.327 . . . . 0.0 116.262 -170.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.4 t 53.14 64.4 1.87 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.619 1.568 . . . . 0.0 112.804 -173.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -155.49 158.23 38.19 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.399 1.88 . . . . 0.0 111.091 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.488 HD22 HG23 ' A' ' 16' ' ' VAL . 6.9 t-20 -141.52 -167.97 2.54 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.659 -1.275 . . . . 0.0 111.721 164.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.59 146.18 31.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 125.579 1.552 . . . . 0.0 109.603 167.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.6 tp -51.41 142.72 13.06 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.891 1.276 . . . . 0.0 112.002 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.73 173.09 1.86 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -122.99 -23.89 4.88 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.092 1.357 . . . . 0.0 113.943 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.8 m -81.42 171.07 15.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.778 1.231 . . . . 0.0 111.947 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.76 106.65 13.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.778 1.231 . . . . 0.0 111.676 -176.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -101.28 162.73 12.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.036 1.735 . . . . 0.0 110.877 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -73.3 105.64 4.79 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.694 -0.629 . . . . 0.0 110.382 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.96 122.63 38.98 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.068 1.347 . . . . 0.0 111.466 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 32.8 t -124.72 91.42 3.44 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.997 1.319 . . . . 0.0 110.726 -173.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -83.98 161.8 20.64 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.601 0.76 . . . . 0.0 111.693 171.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.76 109.78 3.7 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.115 0.966 . . . . 0.0 110.669 163.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.53 130.91 43.6 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.515 1.126 . . . . 0.0 110.828 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.4 t -57.74 150.38 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.321 1.448 . . . . 0.0 112.137 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 68.1 p -123.97 101.19 7.11 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.622 1.569 . . . . 0.0 111.453 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 55.2 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 128.078 2.551 . . . . 0.0 114.512 178.719 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 CA--C 1.538 0.701 0 N-CA-C 113.488 0.534 . . . . 0.0 113.488 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.28 176.82 9.26 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.59 2.356 . . . . 0.0 109.6 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.486 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 11.4 mmpt? -115.28 131.98 56.76 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.982 1.313 . . . . 0.0 110.702 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -136.2 160.67 37.99 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.531 . . . . 0.0 112.151 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -92.2 155.83 17.73 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.631 1.972 . . . . 0.0 112.145 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 107.71 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.652 1.581 . . . . 0.0 111.395 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.1 tptt -136.56 114.73 11.57 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.686 1.595 . . . . 0.0 111.069 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -133.34 132.09 40.88 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.989 1.716 . . . . 0.0 110.609 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 66.1 m -144.87 178.48 7.98 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.523 1.929 . . . . 0.0 111.595 -172.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 m -147.01 102.11 3.48 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.588 -1.32 . . . . 0.0 110.871 178.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -163.35 173.7 12.91 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.47 1.108 . . . . 0.0 113.652 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 168.31 5.19 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 128.133 2.573 . . . . 0.0 113.433 172.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.3 p90 -139.77 140.37 36.68 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.707 1.603 . . . . 0.0 111.868 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.6 t -98.72 143.11 29.44 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.204 1.002 . . . . 0.0 111.487 174.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.486 HG23 HD22 ' A' ' 104' ' ' ASN . 16.5 m -147.22 -178.6 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 126.565 1.946 . . . . 0.0 111.193 -176.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.444 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 3.2 m -127.35 119.53 26.45 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.333 -0.854 . . . . 0.0 111.307 174.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.67 133.59 33.68 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.552 0.741 . . . . 0.0 111.248 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -138.73 114.33 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.337 1.455 . . . . 0.0 108.472 175.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 58.27 56.44 4.48 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.0 1.32 . . . . 0.0 112.489 -170.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.01 25.02 12.65 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.492 2.317 . . . . 0.0 115.091 169.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.39 132.57 5.55 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.921 1.288 . . . . 0.0 109.553 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -76.26 105.52 2.09 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.812 3.008 . . . . 0.0 112.147 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.405 HG12 ' N ' ' A' ' 51' ' ' TRP . 8.5 m -101.02 15.14 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.106 1.363 . . . . 0.0 111.956 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.444 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 24.7 t-80 -157.47 139.82 14.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.877 1.217 . . . . 0.0 112.741 -169.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -96.75 140.58 31.12 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.721 0.808 . . . . 0.0 111.306 173.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 92.1 t -109.8 -58.06 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.073 0.949 . . . . 0.0 111.598 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.08 -173.45 45.6 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 118.648 0.658 . . . . 0.0 113.191 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.4 p -115.46 138.76 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.295 1.038 . . . . 0.0 110.981 178.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 60.46 4.69 4.1 Favored Glycine 0 CA--C 1.544 1.895 0 N-CA-C 116.992 1.557 . . . . 0.0 116.992 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -167.41 158.93 11.99 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.213 2.205 . . . . 0.0 110.749 -174.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.2 m . . . . . 0 CA--C 1.54 0.566 0 C-N-CA 126.004 1.721 . . . . 0.0 111.042 172.983 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t0 . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 121.884 0.85 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.405 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -55.31 -37.74 67.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.51 1.924 . . . . 0.0 112.139 170.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -37.6 78.17 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.775 1.23 . . . . 0.0 112.187 -179.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -92.81 -25.2 18.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.778 1.231 . . . . 0.0 113.587 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -52.65 -41.62 63.94 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.531 1.532 . . . . 0.0 113.15 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -56.83 -61.54 2.36 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.081 0.953 . . . . 0.0 110.588 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -56.5 -26.35 54.15 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -65.73 -48.42 71.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.284 1.434 . . . . 0.0 112.863 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -153.16 24.51 0.55 Allowed 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.277 1.584 . . . . 0.0 115.277 -176.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -129.66 145.1 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.527 -1.358 . . . . 0.0 109.538 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.3 t -145.21 158.67 43.77 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 178.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -90.72 3.44 54.28 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.487 1.915 . . . . 0.0 112.679 167.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.1 t -164.44 113.84 1.17 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.506 1.922 . . . . 0.0 111.3 174.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -66.57 104.25 1.24 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.606 -1.309 . . . . 0.0 110.628 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -115.58 4.3 14.14 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.537 1.535 . . . . 0.0 113.374 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.0 p -72.68 145.21 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.891 1.276 . . . . 0.0 112.721 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -132.47 5.66 4.06 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.17 1.788 . . . . 0.0 113.106 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 34.6 m 52.64 39.72 28.8 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.521 2.328 . . . . 0.0 114.378 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -153.87 -27.35 0.13 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 128.34 2.656 . . . . 0.0 112.213 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -109.1 2.36 21.08 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.709 1.603 . . . . 0.0 113.695 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -61.58 -12.66 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.171 1.388 . . . . 0.0 113.6 177.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -52.44 -34.15 47.46 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.641 1.176 . . . . 0.0 112.879 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.3 t -80.7 2.3 26.53 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.119 1.368 . . . . 0.0 114.218 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.1 p -121.19 -177.45 3.52 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.967 1.707 . . . . 0.0 111.845 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -62.51 -19.66 63.83 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 172.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.73 7.31 24.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.315 1.846 . . . . 0.0 114.558 -171.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -64.07 -5.57 4.94 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.968 2.107 . . . . 0.0 114.904 -176.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -61.92 -5.45 2.12 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.435 1.894 . . . . 0.0 114.681 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.6 t 53.0 35.61 19.88 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.301 2.241 . . . . 0.0 114.847 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 160.57 17.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.868 1.667 . . . . 0.0 113.063 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -68.34 -27.32 66.16 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.059 1.744 . . . . 0.0 115.253 -171.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -162.72 159.04 23.8 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.425 1.49 . . . . 0.0 112.404 166.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -134.19 141.78 47.18 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.3 1.04 . . . . 0.0 110.557 168.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.2 m -108.2 94.12 4.9 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.978 1.311 . . . . 0.0 109.532 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -78.98 136.09 37.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.78 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 88.8 mt -113.26 115.65 50.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 126.077 1.751 . . . . 0.0 108.271 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -85.15 86.41 7.38 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.775 -0.578 . . . . 0.0 110.327 168.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.4 m -142.09 155.04 45.35 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.193 1.397 . . . . 0.0 112.748 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.1 mtp180 -70.36 161.78 74.16 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.239 1.016 . . . . 0.0 110.174 162.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.79 -22.33 37.02 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.764 1.643 . . . . 0.0 114.632 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.26 -58.19 20.6 Favored Pre-proline 0 N--CA 1.474 0.763 0 CA-C-N 119.691 1.132 . . . . 0.0 113.185 -177.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.21 0.5 5.14 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.339 2.692 . . . . 0.0 114.858 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.9 t -102.97 -55.07 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 126.515 1.926 . . . . 0.0 109.712 176.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.0 -44.86 79.27 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.27 -0.894 . . . . 0.0 112.819 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.7 -3.08 32.73 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -173.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.9 mt -53.45 -35.81 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 123.52 0.728 . . . . 0.0 110.473 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.2 p -109.29 158.94 17.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.461 1.104 . . . . 0.0 113.236 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -155.43 106.04 2.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.169 1.788 . . . . 0.0 109.961 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 4.09 87.57 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.483 1.04 . . . . 0.0 114.886 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.1 mt -75.73 115.15 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 118.5 1.15 . . . . 0.0 111.27 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.7 -11.89 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.628 1.971 . . . . 0.0 110.847 172.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 9.01 1.53 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.859 2.463 . . . . 0.0 116.1 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 83.0 p 49.27 63.76 2.02 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.757 1.623 . . . . 0.0 113.455 -172.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -154.61 155.71 35.2 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 126.715 2.006 . . . . 0.0 111.116 -176.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.486 HD22 HG23 ' A' ' 16' ' ' VAL . 6.7 t-20 -141.9 -167.23 2.4 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.722 -1.236 . . . . 0.0 111.475 162.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 19.2 t -127.41 143.59 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.762 1.625 . . . . 0.0 108.711 170.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -50.05 141.25 11.2 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.567 1.147 . . . . 0.0 111.968 168.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 173.2 1.28 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 172.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -119.88 -32.74 4.16 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.75 1.22 . . . . 0.0 113.406 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.8 m -74.84 172.11 12.79 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.506 1.522 . . . . 0.0 112.168 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -121.21 116.63 25.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.583 1.153 . . . . 0.0 110.923 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -113.54 157.25 22.28 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.913 1.685 . . . . 0.0 109.805 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.63 112.45 4.17 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.398 0.545 . . . . 0.0 110.106 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.96 123.07 48.83 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.372 1.469 . . . . 0.0 110.843 -170.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 28.3 t -129.46 97.42 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.63 1.172 . . . . 0.0 109.924 -167.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -87.73 159.75 18.36 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.742 0.817 . . . . 0.0 110.779 171.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -145.08 128.09 16.52 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.963 0.905 . . . . 0.0 108.769 158.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -116.39 127.66 54.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.014 1.326 . . . . 0.0 109.849 -175.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 36.7 t -59.14 145.22 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-O 121.263 0.554 . . . . 0.0 112.111 -176.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.7 t -132.93 103.15 5.92 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.225 1.81 . . . . 0.0 110.955 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 99.2 p . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.601 1.56 . . . . 0.0 114.702 -179.481 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo . . . . . 0 CA--C 1.536 0.625 0 N-CA-C 112.039 -0.024 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 m -140.08 171.27 14.41 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.959 1.703 . . . . 0.0 110.477 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -92.35 130.65 37.98 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.114 1.366 . . . . 0.0 110.252 -178.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -137.54 161.04 37.46 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.412 1.085 . . . . 0.0 112.85 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -95.41 160.01 14.73 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.491 2.317 . . . . 0.0 111.665 178.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.47 106.16 18.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.957 1.703 . . . . 0.0 110.933 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -134.48 118.42 17.32 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.994 1.718 . . . . 0.0 111.377 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -125.64 152.92 44.55 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.117 1.367 . . . . 0.0 111.464 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 19.6 t -154.51 175.49 13.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.367 1.467 . . . . 0.0 111.42 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -144.88 101.65 3.67 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.956 -1.09 . . . . 0.0 110.441 173.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.72 178.64 7.72 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.082 1.353 . . . . 0.0 113.442 -178.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 170.78 9.16 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 128.053 2.541 . . . . 0.0 113.661 174.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -141.69 141.13 33.33 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.067 1.747 . . . . 0.0 112.065 -176.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.6 t -101.21 140.54 35.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.817 0.847 . . . . 0.0 111.793 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.488 HG23 HD22 ' A' ' 104' ' ' ASN . 15.5 m -146.58 -179.41 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 126.452 1.901 . . . . 0.0 111.251 -176.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.2 m -125.96 116.27 21.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.815 1.246 . . . . 0.0 111.04 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 m -85.29 132.32 34.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.594 0.634 . . . . 0.0 111.289 173.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -136.72 116.28 12.88 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 125.188 1.395 . . . . 0.0 108.323 174.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 57.87 55.98 5.04 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.86 1.264 . . . . 0.0 112.38 -170.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.33 25.18 12.13 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 127.439 2.295 . . . . 0.0 115.072 169.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.09 132.71 5.33 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.844 1.257 . . . . 0.0 109.787 -174.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.99 106.71 2.3 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 124.008 3.139 . . . . 0.0 113.5 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.3 m -108.65 14.95 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.888 2.075 . . . . 0.0 112.619 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -151.66 143.91 24.02 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.612 -1.305 . . . . 0.0 111.672 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -100.63 132.68 45.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 111.425 176.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.1 t -107.85 -53.52 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.908 0.883 . . . . 0.0 111.982 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.64 -172.5 44.28 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-N 118.93 0.786 . . . . 0.0 114.504 -173.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -126.18 128.88 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.479 1.511 . . . . 0.0 109.722 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.58 2.92 8.3 Favored Glycine 0 CA--C 1.539 1.555 0 N-CA-C 116.354 1.302 . . . . 0.0 116.354 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -168.88 163.39 11.61 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 128.555 2.742 . . . . 0.0 110.232 -176.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.1 m . . . . . 0 CA--C 1.539 0.55 0 C-N-CA 125.733 1.613 . . . . 0.0 109.848 170.161 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 . . . . . 0 CA--C 1.541 0.614 0 CA-C-O 121.978 0.894 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.442 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.2 t-105 -55.37 -36.74 66.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.727 1.611 . . . . 0.0 111.406 167.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.81 -32.34 70.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.907 1.283 . . . . 0.0 112.465 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.1 p -97.94 -24.72 15.26 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.763 1.225 . . . . 0.0 113.737 175.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -52.85 -40.21 63.2 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.768 1.627 . . . . 0.0 112.992 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -58.08 -61.59 2.44 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.779 0.832 . . . . 0.0 111.196 172.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.93 -28.73 38.79 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 tmtm? -66.42 -44.84 81.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.676 1.59 . . . . 0.0 114.042 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -155.72 21.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.8 mt -127.59 146.52 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 120.145 -1.597 . . . . 0.0 109.412 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.45 154.64 43.15 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -88.89 2.1 54.3 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.949 1.7 . . . . 0.0 112.343 168.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.83 106.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.387 1.875 . . . . 0.0 111.409 174.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 ttp-105 -67.23 114.73 6.2 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.494 -1.379 . . . . 0.0 110.178 171.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -126.98 5.26 6.52 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.255 1.422 . . . . 0.0 113.293 176.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.52 HG22 ' H ' ' A' ' 67' ' ' CYS . 14.9 p -71.37 150.3 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.24 1.416 . . . . 0.0 113.125 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -132.62 3.3 3.84 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.012 1.725 . . . . 0.0 112.877 173.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.52 ' H ' HG22 ' A' ' 65' ' ' VAL 0.251 90.2 m 45.65 57.66 4.84 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.743 2.417 . . . . 0.0 112.083 -171.606 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -156.34 -43.69 0.07 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.585 2.354 . . . . 0.0 111.736 -163.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -113.47 0.02 14.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.714 2.005 . . . . 0.0 113.573 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.2 pt -60.65 -11.03 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.21 1.404 . . . . 0.0 113.966 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -25.76 29.21 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 167.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 t -89.4 -2.54 58.44 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.557 1.543 . . . . 0.0 113.794 176.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 p -108.82 -179.52 3.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.904 1.682 . . . . 0.0 111.51 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -69.45 -14.58 62.96 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 172.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -81.63 6.43 15.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.348 1.859 . . . . 0.0 114.743 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -65.23 -5.03 5.98 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 128.413 2.685 . . . . 0.0 115.237 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -62.56 -2.32 1.06 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.676 1.99 . . . . 0.0 115.25 -173.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 8.5 t 56.14 31.9 19.13 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.169 1.788 . . . . 0.0 113.263 -173.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.36 154.46 20.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.482 1.113 . . . . 0.0 112.03 176.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -63.64 -33.61 76.0 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.007 1.323 . . . . 0.0 113.692 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -164.43 160.21 20.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.097 1.759 . . . . 0.0 112.123 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t30 -138.26 123.62 19.42 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.227 1.011 . . . . 0.0 110.422 172.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 42.0 m -87.37 94.74 9.77 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.842 0.857 . . . . 0.0 109.428 173.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -78.75 132.85 37.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.002 -0.436 . . . . 0.0 111.1 172.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.1 mt -111.8 113.44 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.55 1.54 . . . . 0.0 107.966 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -85.82 84.39 7.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.89 -0.506 . . . . 0.0 110.522 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.0 m -141.2 159.03 43.07 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.998 1.319 . . . . 0.0 113.249 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -71.41 162.71 71.29 Favored Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 124.739 1.216 . . . . 0.0 111.363 162.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.22 -23.73 28.38 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.556 2.171 . . . . 0.0 114.355 176.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -60.86 -58.23 20.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-N 119.68 1.127 . . . . 0.0 112.884 -177.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.89 0.89 5.08 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.034 2.489 . . . . 0.0 114.93 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.54 -57.4 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 126.937 2.095 . . . . 0.0 110.156 177.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -40.03 79.67 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.335 -0.853 . . . . 0.0 112.708 -177.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.81 -3.5 44.82 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 62.2 mt -52.84 -36.36 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.777 0.717 . . . . 0.0 110.529 169.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.63 159.58 16.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.3 1.04 . . . . 0.0 113.081 174.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -156.0 104.99 2.32 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.535 1.534 . . . . 0.0 110.646 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.63 5.1 87.03 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.299 0.952 . . . . 0.0 114.99 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.7 mt -75.28 115.87 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.534 1.167 . . . . 0.0 111.155 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.2 mt -111.54 -11.92 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 126.629 1.972 . . . . 0.0 110.946 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 4.3 5.09 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.438 2.295 . . . . 0.0 116.007 -171.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 51.81 68.28 0.83 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.805 1.642 . . . . 0.0 113.041 -170.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -156.48 163.57 39.25 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.133 1.773 . . . . 0.0 111.018 176.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.488 HD22 HG23 ' A' ' 16' ' ' VAL . 6.8 t-20 -143.52 -165.37 2.08 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.884 -1.135 . . . . 0.0 111.338 163.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.21 146.83 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 125.448 1.499 . . . . 0.0 109.285 165.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.0 tp -50.96 142.11 12.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.623 1.169 . . . . 0.0 111.409 167.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.19 174.32 0.94 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 171.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -117.19 -32.55 4.96 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.769 1.228 . . . . 0.0 113.529 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -78.76 176.01 9.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.519 1.927 . . . . 0.0 112.325 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -121.81 111.03 16.63 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.099 -1.001 . . . . 0.0 111.49 -177.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -107.95 160.33 15.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.203 1.801 . . . . 0.0 109.935 -174.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -70.91 110.78 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.687 -0.633 . . . . 0.0 110.845 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.16 126.87 50.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.813 1.645 . . . . 0.0 110.981 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.3 t -132.23 96.9 3.98 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.686 1.194 . . . . 0.0 109.961 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -103.6 135.66 44.76 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.157 1.383 . . . . 0.0 110.16 -178.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 22.1 m -116.83 146.25 43.01 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.936 -1.102 . . . . 0.0 108.646 168.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -134.94 124.42 24.89 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.035 0.934 . . . . 0.0 109.344 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.3 t -58.01 147.37 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.015 0.926 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.7 t -136.45 86.11 2.2 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 122.782 1.277 . . . . 0.0 112.836 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 61.3 m . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.198 1.799 . . . . 0.0 112.784 173.739 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo . . . . . 0 CA--C 1.54 0.779 0 N-CA-C 112.784 0.263 . . . . 0.0 112.784 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 85.9 m -140.4 168.27 20.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.575 2.35 . . . . 0.0 109.599 176.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -93.45 140.44 29.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.324 1.05 . . . . 0.0 110.22 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -137.64 160.86 38.02 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.699 1.2 . . . . 0.0 112.46 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -94.46 153.74 17.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.741 2.016 . . . . 0.0 112.01 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.18 103.59 16.25 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.381 1.473 . . . . 0.0 111.22 -174.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -133.64 118.83 18.64 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.143 1.377 . . . . 0.0 111.456 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -129.51 152.22 49.29 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.04 1.736 . . . . 0.0 110.942 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.8 m -155.23 175.11 14.28 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.92 1.688 . . . . 0.0 111.43 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -144.71 104.77 4.06 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.936 -1.103 . . . . 0.0 110.838 175.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.77 172.17 6.91 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.916 1.286 . . . . 0.0 113.405 -171.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 172.86 1.09 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 128.329 2.652 . . . . 0.0 114.224 168.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -141.17 143.01 33.98 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.639 1.975 . . . . 0.0 111.7 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.4 t -103.49 138.85 39.63 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.069 0.947 . . . . 0.0 111.097 176.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.5 m -145.45 -179.49 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 125.905 1.682 . . . . 0.0 111.435 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.6 m -126.22 117.44 23.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.608 1.163 . . . . 0.0 111.527 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.87 130.08 34.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.832 0.853 . . . . 0.0 111.201 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -138.95 112.6 8.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.064 1.346 . . . . 0.0 108.925 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 58.82 58.51 3.21 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.154 1.382 . . . . 0.0 112.331 -172.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 62.84 27.64 16.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 127.27 2.228 . . . . 0.0 114.841 171.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.75 133.51 5.49 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.983 1.313 . . . . 0.0 109.767 -176.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 101.04 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 124.149 3.232 . . . . 0.0 112.308 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 m -96.21 1.26 10.38 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 C-N-CA 125.11 1.364 . . . . 0.0 112.447 -178.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -143.82 139.83 29.53 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 121.357 1.89 . . . . 0.0 110.997 -171.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -88.38 145.38 25.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.155 0.582 . . . . 0.0 110.294 172.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 73.6 t -114.43 -57.37 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.735 0.814 . . . . 0.0 111.426 173.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.09 -174.79 43.83 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 123.981 0.8 . . . . 0.0 112.509 -172.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.73 132.61 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.588 0.755 . . . . 0.0 112.118 -173.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.08 0.19 14.04 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 115.287 0.875 . . . . 0.0 115.287 -173.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 96.2 p -173.81 167.83 4.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.684 2.794 . . . . 0.0 110.321 -172.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.1 m . . . . . 0 CA--C 1.54 0.591 0 C-N-CA 125.122 1.369 . . . . 0.0 110.707 172.603 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 p30 . . . . . 0 CA--C 1.541 0.617 0 CA-C-O 123.259 1.504 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.2 t-105 -55.97 -33.61 64.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.066 1.746 . . . . 0.0 112.863 171.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -44.52 92.71 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.09 -1.006 . . . . 0.0 111.039 -178.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.8 p -81.49 -24.7 36.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.503 1.521 . . . . 0.0 114.563 173.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -51.3 -43.59 61.71 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.211 1.404 . . . . 0.0 112.126 174.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -57.89 -63.08 1.37 Allowed 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 124.596 1.158 . . . . 0.0 110.922 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -21.52 53.29 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -65.98 -48.74 70.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.354 1.461 . . . . 0.0 114.431 174.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -152.36 19.96 0.64 Allowed 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.1 mt -125.63 149.98 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.768 1.627 . . . . 0.0 108.527 177.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -144.51 156.86 44.37 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.453 0.644 . . . . 0.0 112.532 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -93.0 4.35 54.16 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.716 1.606 . . . . 0.0 112.16 169.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 t -160.73 111.76 1.83 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.647 1.979 . . . . 0.0 111.015 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.0 ttp85 -67.08 101.72 0.91 Allowed 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.564 -1.335 . . . . 0.0 110.557 172.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -113.85 4.42 15.87 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.654 1.582 . . . . 0.0 113.2 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.5 p -72.43 141.67 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.682 1.193 . . . . 0.0 112.427 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -128.7 7.94 5.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.476 1.91 . . . . 0.0 112.698 172.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.5 m 49.87 47.12 23.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.054 2.542 . . . . 0.0 113.685 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -163.0 -28.46 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.029 2.531 . . . . 0.0 111.86 179.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -105.93 0.7 26.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.465 1.506 . . . . 0.0 113.853 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 pt -60.94 -11.69 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.035 1.334 . . . . 0.0 113.686 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -23.69 28.85 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.3 p -96.11 -4.9 41.99 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.5 p -97.04 -176.01 3.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.824 1.65 . . . . 0.0 111.476 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -64.75 -18.02 64.67 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 170.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -92.7 11.79 25.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.99 1.716 . . . . 0.0 114.145 -169.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -63.57 -8.46 9.78 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.823 2.449 . . . . 0.0 115.229 -175.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -62.75 -7.44 4.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.504 1.921 . . . . 0.0 114.71 -173.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.2 t 38.38 61.24 1.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.947 2.099 . . . . 0.0 113.653 -166.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 161.23 26.98 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.881 1.273 . . . . 0.0 112.11 160.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.25 -32.25 73.55 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.512 1.525 . . . . 0.0 114.525 -172.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -161.84 160.2 27.83 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 169.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -135.03 118.69 17.06 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.836 0.854 . . . . 0.0 110.888 171.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 25.8 m -81.84 95.55 7.35 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.036 0.534 . . . . 0.0 109.708 172.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 -80.94 131.05 35.31 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.811 -0.556 . . . . 0.0 111.892 175.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.2 mt -106.76 115.24 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 125.38 1.472 . . . . 0.0 107.779 173.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -88.21 92.53 9.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.044 0.449 . . . . 0.0 109.89 167.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.2 t -147.44 -173.7 4.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.635 1.174 . . . . 0.0 112.999 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -99.91 162.53 20.75 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 128.368 2.667 . . . . 0.0 110.995 172.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.0 -25.23 23.11 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.431 2.087 . . . . 0.0 114.244 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -58.41 18.36 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.036 -177.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -69.3 0.35 5.42 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.336 2.69 . . . . 0.0 114.831 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.5 t -102.33 -58.66 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.85 2.06 . . . . 0.0 110.001 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.27 -38.86 82.17 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.319 -0.863 . . . . 0.0 112.777 -177.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.99 -4.49 47.29 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.5 mt -53.23 -35.02 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.858 0.754 . . . . 0.0 110.798 170.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.7 p -113.24 158.08 20.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.005 1.322 . . . . 0.0 113.077 174.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -153.93 104.73 2.69 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.942 1.697 . . . . 0.0 110.373 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.84 4.97 88.41 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.206 0.908 . . . . 0.0 114.986 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.4 mt -76.35 118.82 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 118.607 1.203 . . . . 0.0 111.131 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 3.3 mt -115.69 -6.36 11.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 126.943 2.097 . . . . 0.0 110.829 173.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.04 7.93 4.41 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.383 2.273 . . . . 0.0 115.682 -172.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 85.2 p 50.43 61.48 3.18 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.867 1.667 . . . . 0.0 113.912 -174.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -157.58 154.17 28.07 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 126.284 1.833 . . . . 0.0 110.54 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -137.99 -169.81 2.64 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.095 -1.003 . . . . 0.0 111.63 166.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.4 p -122.63 144.38 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.671 1.588 . . . . 0.0 109.354 169.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.6 tp -52.51 141.79 19.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.526 1.131 . . . . 0.0 111.49 169.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.31 172.25 1.57 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 121.923 0.868 . . . . 0.0 113.265 172.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.3 t -117.67 -30.69 5.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.817 1.247 . . . . 0.0 113.263 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.6 m -78.85 170.72 16.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.464 1.506 . . . . 0.0 112.15 177.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -118.51 108.12 14.61 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.577 1.151 . . . . 0.0 111.063 -176.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -100.8 161.55 13.52 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.61 1.564 . . . . 0.0 110.324 -173.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -70.38 108.34 4.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.735 -0.603 . . . . 0.0 110.125 179.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.35 130.4 47.52 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 124.695 1.198 . . . . 0.0 111.888 -175.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.9 t -135.93 95.36 3.2 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.096 0.959 . . . . 0.0 110.85 -172.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -86.54 162.56 17.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.723 0.773 . . . . 0.0 111.162 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.72 135.15 16.08 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.482 1.113 . . . . 0.0 108.975 157.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -120.46 130.43 54.3 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.063 1.345 . . . . 0.0 110.442 -176.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.5 145.54 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 124.006 0.922 . . . . 0.0 111.925 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.8 t -135.41 78.21 1.71 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.681 1.192 . . . . 0.0 112.354 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.253 1.254 0 C-N-CA 126.185 1.794 . . . . 0.0 112.924 172.853 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo . . . . . 0 CA--C 1.538 0.721 0 N-CA-C 113.329 0.473 . . . . 0.0 113.329 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.38 179.67 6.65 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.224 2.209 . . . . 0.0 110.275 -176.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -109.87 127.52 54.76 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.237 1.415 . . . . 0.0 110.373 175.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -137.91 163.62 31.02 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.531 1.132 . . . . 0.0 113.36 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.1 mtpt -104.24 157.63 17.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.59 2.356 . . . . 0.0 111.626 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.58 113.7 25.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.385 1.874 . . . . 0.0 110.84 -177.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -136.13 102.63 5.07 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.842 1.257 . . . . 0.0 113.092 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -102.61 146.07 28.72 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.285 1.434 . . . . 0.0 111.368 173.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.1 m -145.69 169.69 17.97 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.227 1.811 . . . . 0.0 111.183 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.5 m -144.44 104.32 4.06 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 120.87 -1.144 . . . . 0.0 111.039 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.34 173.12 5.83 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.02 1.328 . . . . 0.0 113.163 -170.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.61 175.63 1.04 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.359 2.264 . . . . 0.0 114.315 169.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -143.66 144.76 32.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.221 1.809 . . . . 0.0 111.755 177.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.5 t -104.6 141.32 36.62 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.446 1.098 . . . . 0.0 110.847 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.474 HG23 HD22 ' A' ' 104' ' ' ASN . 16.6 m -148.24 -178.31 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.024 1.73 . . . . 0.0 111.738 -173.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -127.98 115.82 19.11 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.129 1.372 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.67 132.62 34.12 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.545 0.738 . . . . 0.0 111.857 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -135.85 117.2 14.64 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.441 1.496 . . . . 0.0 108.453 173.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 56.45 56.29 5.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.744 1.218 . . . . 0.0 112.357 -171.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 65.21 25.21 12.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 127.496 2.318 . . . . 0.0 115.038 169.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.93 132.34 5.21 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.784 1.234 . . . . 0.0 109.723 -174.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.71 109.81 2.97 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.595 2.863 . . . . 0.0 113.468 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.2 m -108.84 17.19 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.606 1.963 . . . . 0.0 112.686 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -153.8 144.67 22.67 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.635 -1.29 . . . . 0.0 111.871 174.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -88.25 149.23 23.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.574 0.749 . . . . 0.0 110.056 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 81.9 t -124.5 -45.86 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.657 0.783 . . . . 0.0 112.515 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.29 -179.39 48.23 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 118.98 0.809 . . . . 0.0 114.12 -175.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 p -132.36 118.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.54 1.536 . . . . 0.0 110.704 -172.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.21 2.28 58.59 Favored Glycine 0 CA--C 1.541 1.694 0 C-N-CA 124.139 0.876 . . . . 0.0 114.909 -172.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 94.0 p -173.77 169.19 4.23 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.466 2.706 . . . . 0.0 110.097 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.7 m . . . . . 0 CA--C 1.538 0.506 0 C-N-CA 124.888 1.275 . . . . 0.0 109.085 165.264 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 p30 . . . . . 0 CA--C 1.542 0.64 0 CA-C-O 122.462 1.125 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -60.05 -34.81 73.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.732 1.613 . . . . 0.0 113.075 177.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -44.38 96.62 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.578 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.0 p -79.54 -26.76 41.36 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -52.38 -43.23 64.61 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.858 1.663 . . . . 0.0 112.889 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -57.46 -61.45 2.48 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.409 1.084 . . . . 0.0 110.813 174.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.52 -26.95 56.22 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -49.75 68.74 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.313 1.445 . . . . 0.0 114.441 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -149.57 20.57 0.92 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -174.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -127.85 147.48 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.323 . . . . 0.0 109.566 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.12 154.58 43.33 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -87.63 0.68 55.32 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.05 1.74 . . . . 0.0 112.54 167.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.5 t -164.02 105.02 0.9 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.364 1.866 . . . . 0.0 111.202 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.2 ttp85 -67.41 105.81 1.91 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.558 -1.339 . . . . 0.0 110.934 173.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -117.75 3.75 12.28 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.527 1.531 . . . . 0.0 113.116 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.9 t -79.01 143.27 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.799 1.24 . . . . 0.0 111.66 -175.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -131.96 6.42 4.28 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.746 1.619 . . . . 0.0 113.313 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.2 m 50.43 46.72 24.98 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.838 2.055 . . . . 0.0 113.751 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -152.34 -29.14 0.16 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 127.118 2.167 . . . . 0.0 113.049 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -105.05 -2.72 24.05 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.307 1.443 . . . . 0.0 113.733 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -60.26 -12.52 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.656 1.582 . . . . 0.0 114.304 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -32.34 56.16 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.911 0.884 . . . . 0.0 112.018 167.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.8 t -88.7 -6.44 57.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.781 1.632 . . . . 0.0 114.461 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.4 p -109.73 -174.52 2.52 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.209 1.403 . . . . 0.0 112.191 -176.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -62.04 -20.83 64.38 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 120.917 -1.115 . . . . 0.0 113.618 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -94.67 17.4 13.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.157 1.783 . . . . 0.0 113.509 -169.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -67.57 -8.44 34.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.479 2.312 . . . . 0.0 114.72 -172.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -62.15 -3.62 1.36 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.973 2.509 . . . . 0.0 115.312 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.5 t 52.33 34.23 14.48 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.254 2.222 . . . . 0.0 115.054 176.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.26 164.31 5.53 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.503 1.921 . . . . 0.0 113.453 171.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -62.99 -39.59 95.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.948 1.299 . . . . 0.0 113.979 -173.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -161.02 164.79 30.69 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.487 1.515 . . . . 0.0 112.631 171.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -131.4 147.19 52.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.276 1.03 . . . . 0.0 109.952 164.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 47.3 m -107.3 92.55 4.12 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.183 1.393 . . . . 0.0 109.436 176.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -80.16 124.83 29.13 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.695 0.798 . . . . 0.0 111.708 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.0 mt -99.68 117.55 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.769 1.628 . . . . 0.0 108.432 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -87.56 86.35 7.2 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.573 -0.704 . . . . 0.0 110.53 169.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.0 m -142.9 156.96 45.0 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.381 1.473 . . . . 0.0 112.965 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -71.47 162.94 70.09 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 124.699 1.199 . . . . 0.0 110.585 163.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.02 -23.39 29.65 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.076 1.851 . . . . 0.0 114.52 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -61.25 -57.64 24.34 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.059 -0.972 . . . . 0.0 113.036 -177.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.68 0.32 5.75 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.035 2.49 . . . . 0.0 114.949 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.8 t -102.78 -54.45 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.527 1.931 . . . . 0.0 109.813 176.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -45.6 76.86 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.214 -0.929 . . . . 0.0 112.712 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.96 -2.93 32.8 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 -172.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.34 -36.23 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.501 0.72 . . . . 0.0 110.376 169.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.09 158.24 17.58 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.218 1.007 . . . . 0.0 113.172 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -155.97 101.51 2.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.129 1.771 . . . . 0.0 109.992 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 2.98 79.86 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.58 1.086 . . . . 0.0 114.88 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.2 mt -73.52 116.07 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.615 1.207 . . . . 0.0 111.249 -178.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.4 mt -108.8 -13.11 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 110.874 171.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.67 5.64 2.99 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 127.623 2.369 . . . . 0.0 116.298 -169.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.9 t 52.08 64.34 1.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.446 1.499 . . . . 0.0 112.661 -172.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -155.02 160.43 41.05 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.992 1.717 . . . . 0.0 111.262 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . 0.474 HD22 HG23 ' A' ' 16' ' ' VAL . 6.5 t-20 -144.67 -166.73 2.47 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.682 -1.262 . . . . 0.0 111.509 163.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.62 148.68 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 125.654 1.582 . . . . 0.0 109.589 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.01 142.16 25.87 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 111.476 168.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.27 172.67 2.36 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 122.558 1.17 . . . . 0.0 113.46 171.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 18.1 p -115.89 -36.83 4.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.407 1.883 . . . . 0.0 112.93 -176.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.1 m -74.52 171.7 13.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.556 1.942 . . . . 0.0 112.708 177.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -119.54 105.01 10.81 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.588 1.155 . . . . 0.0 111.31 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -98.29 162.6 13.1 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.866 1.666 . . . . 0.0 110.309 -175.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -71.51 107.38 4.38 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.726 -0.609 . . . . 0.0 110.11 177.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -100.58 129.76 46.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.49 1.116 . . . . 0.0 111.53 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 29.5 t -130.28 94.11 3.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.436 1.494 . . . . 0.0 109.497 -172.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -87.95 164.23 15.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.398 1.094 . . . . 0.0 110.663 170.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 11.5 m -129.57 168.29 16.63 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.958 1.303 . . . . 0.0 109.096 153.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -144.43 124.21 13.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.168 -0.958 . . . . 0.0 109.632 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.6 p -55.07 146.15 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 123.916 0.887 . . . . 0.0 112.473 177.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -131.85 80.65 1.93 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.283 1.433 . . . . 0.0 111.003 174.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.2 m . . . . . 0 C--O 1.253 1.276 0 C-N-CA 127.266 2.226 . . . . 0.0 113.567 178.655 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 118.557 -0.735 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.74 -52.54 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 121.765 1.643 . . . . 0.0 113.07 -176.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.26 178.21 7.88 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.417 1.887 . . . . 0.0 110.391 -176.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -105.64 126.81 52.58 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.641 1.177 . . . . 0.0 110.28 -178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 -133.48 155.99 48.56 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.874 1.27 . . . . 0.0 111.694 -178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -100.67 153.63 19.27 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.865 1.666 . . . . 0.0 112.302 176.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.37 112.48 19.37 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.702 1.601 . . . . 0.0 111.788 -172.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.4 tppp? -132.34 119.54 20.86 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.851 1.66 . . . . 0.0 110.936 174.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -132.08 150.2 52.22 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.516 1.526 . . . . 0.0 110.895 171.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.9 t -149.93 174.92 12.15 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.163 1.385 . . . . 0.0 111.705 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.6 m -141.18 104.03 4.55 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.417 -0.802 . . . . 0.0 111.004 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -165.91 173.16 10.8 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 124.947 1.299 . . . . 0.0 113.038 -172.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -65.7 173.2 2.94 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.856 2.063 . . . . 0.0 113.427 169.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.0 p90 -143.15 155.88 44.66 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.402 1.881 . . . . 0.0 110.422 179.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.9 t -113.62 145.94 40.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.237 1.415 . . . . 0.0 111.778 175.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.2 m -148.67 -179.3 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 126.314 1.845 . . . . 0.0 111.774 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.9 m -124.85 119.15 28.02 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 125.273 1.429 . . . . 0.0 111.893 174.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 12.5 t -85.44 131.15 34.43 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.508 1.123 . . . . 0.0 111.5 175.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -139.53 112.53 8.06 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.489 1.116 . . . . 0.0 109.303 175.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 58.66 58.22 3.4 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.33 1.452 . . . . 0.0 112.421 -170.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.44 25.55 13.35 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 127.583 2.353 . . . . 0.0 114.83 169.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.46 134.91 5.89 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 125.093 1.357 . . . . 0.0 109.701 -176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.29 111.06 3.19 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 123.696 2.931 . . . . 0.0 113.705 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.458 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.3 m -109.85 16.09 7.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 126.35 1.86 . . . . 0.0 112.761 -179.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -152.64 137.01 16.67 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 120.712 -1.242 . . . . 0.0 110.621 177.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -79.72 152.41 29.89 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 168.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.1 t -126.67 -47.53 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.594 0.758 . . . . 0.0 112.824 174.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.45 -174.69 46.89 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.474 1.034 . . . . 0.0 115.103 -175.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 41.3 t -125.75 121.25 59.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 C-N-CA 125.98 1.712 . . . . 0.0 109.799 -174.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 63.74 4.39 10.17 Favored Glycine 0 CA--C 1.542 1.768 0 N-CA-C 115.981 1.152 . . . . 0.0 115.981 -175.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -168.32 163.98 12.95 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 127.747 2.419 . . . . 0.0 110.54 -177.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.7 m -105.77 113.2 26.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.05 1.74 . . . . 0.0 111.129 173.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.0 119.7 5.28 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 125.007 1.289 . . . . 0.0 112.637 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 37.1 m -56.49 135.47 54.37 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.353 1.861 . . . . 0.0 113.559 -179.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -103.92 14.61 52.54 Favored Glycine 0 CA--C 1.537 1.432 0 C-N-CA 125.68 1.609 . . . . 0.0 115.62 -173.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -74.2 32.76 0.94 Allowed Glycine 0 CA--C 1.54 1.636 0 C-N-CA 126.596 2.046 . . . . 0.0 116.591 -172.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 75.4 m -134.7 167.55 20.64 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.638 1.975 . . . . 0.0 111.928 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.91 15.22 6.48 Favored Glycine 0 CA--C 1.54 1.6 0 C-N-CA 125.665 1.602 . . . . 0.0 116.087 -177.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 66.0 mt -64.53 139.5 21.26 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 126.048 1.739 . . . . 0.0 110.657 -176.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -139.06 17.87 2.62 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.71 1.604 . . . . 0.0 113.06 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.7 mt -75.41 -17.87 60.07 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 120.845 -1.159 . . . . 0.0 112.59 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -74.25 170.32 15.81 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.882 1.673 . . . . 0.0 112.942 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 91.4 m -74.48 -25.93 59.69 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 121.467 -0.771 . . . . 0.0 112.966 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.3 p 42.83 62.5 1.75 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.061 2.144 . . . . 0.0 114.626 -177.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.0 mp -65.44 -4.22 5.42 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 114.9 1.445 . . . . 0.0 114.9 179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.5 p -60.7 -39.63 89.24 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.078 1.351 . . . . 0.0 114.033 174.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -119.3 108.73 14.97 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.117 1.367 . . . . 0.0 111.003 -177.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.24 0.33 61.53 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 125.098 1.332 . . . . 0.0 115.201 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.1 m -137.53 -169.47 2.53 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.035 1.417 . . . . 0.0 111.408 175.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -154.55 172.18 18.23 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.879 1.672 . . . . 0.0 109.64 -174.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.458 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.5 t-105 -55.59 -37.22 67.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.826 1.65 . . . . 0.0 111.274 167.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -26.24 63.52 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.212 1.805 . . . . 0.0 113.123 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.8 p -107.8 -24.55 11.64 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.653 1.581 . . . . 0.0 113.815 174.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -50.19 -42.29 50.97 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.476 1.91 . . . . 0.0 112.666 171.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -56.22 -63.03 1.32 Allowed 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 124.698 1.199 . . . . 0.0 110.785 173.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -58.87 -27.02 64.78 Favored 'General case' 0 N--CA 1.484 1.253 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptt -62.36 -54.12 45.1 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.667 1.187 . . . . 0.0 113.141 -177.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.8 p80 -147.75 22.64 1.13 Allowed 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -176.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -124.8 150.03 29.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.532 -1.355 . . . . 0.0 109.446 175.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.7 t -145.19 150.73 37.26 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 174.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -84.08 -1.14 54.34 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 125.572 1.549 . . . . 0.0 112.92 168.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -162.43 108.2 1.22 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.271 1.829 . . . . 0.0 111.312 177.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.2 ttp85 -68.35 108.84 3.38 Favored 'General case' 0 N--CA 1.475 0.784 0 O-C-N 120.219 -1.55 . . . . 0.0 110.806 172.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -114.45 5.78 15.72 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.646 1.578 . . . . 0.0 112.569 171.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.4 t -74.5 136.09 25.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 125.258 1.423 . . . . 0.0 111.562 -176.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -125.56 3.83 7.59 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.054 1.741 . . . . 0.0 113.147 176.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 21.6 m 56.83 30.96 18.72 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.151 2.18 . . . . 0.0 114.651 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -146.09 -19.03 0.45 Allowed 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 128.334 2.654 . . . . 0.0 112.929 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -110.31 -2.59 16.64 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.793 1.637 . . . . 0.0 113.478 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.5 pt -65.36 -4.87 2.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 C-N-CA 125.505 1.522 . . . . 0.0 114.021 179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 23.4 ptm -54.22 -28.01 38.21 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.524 1.129 . . . . 0.0 113.665 159.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 11.5 t -87.69 -26.94 22.72 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.444 1.497 . . . . 0.0 113.458 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.7 p -87.94 -178.55 6.04 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.866 1.266 . . . . 0.0 111.934 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -65.47 -16.0 63.21 Favored 'General case' 0 CA--C 1.546 0.818 0 O-C-N 120.932 -1.105 . . . . 0.0 113.634 176.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -90.75 19.07 5.75 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.485 1.914 . . . . 0.0 113.929 -173.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -67.47 -7.84 28.75 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 127.025 2.13 . . . . 0.0 114.348 -177.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -61.99 -0.87 0.55 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 128.239 2.616 . . . . 0.0 115.882 -173.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 t 49.57 51.63 16.06 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.112 1.765 . . . . 0.0 113.182 -176.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 167.35 2.41 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.896 1.278 . . . . 0.0 112.52 170.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -76.78 -30.03 56.31 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.833 1.253 . . . . 0.0 112.622 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.31 169.32 17.64 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.711 2.004 . . . . 0.0 111.325 168.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -143.95 161.86 37.64 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.045 0.938 . . . . 0.0 110.396 159.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 62.6 m -124.01 92.3 3.64 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.153 1.381 . . . . 0.0 110.247 -177.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -78.6 121.51 24.74 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.248 1.019 . . . . 0.0 111.262 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.3 mt -94.43 116.05 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 124.759 1.224 . . . . 0.0 107.962 171.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -86.64 90.77 8.37 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 121.662 -0.649 . . . . 0.0 109.83 167.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 57.7 p -145.52 170.72 15.84 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.132 1.373 . . . . 0.0 112.494 173.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -78.25 163.46 61.97 Favored Pre-proline 0 N--CA 1.475 0.792 0 C-N-CA 124.367 1.067 . . . . 0.0 109.951 164.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.68 -24.44 18.42 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.167 1.912 . . . . 0.0 113.987 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -59.85 -55.39 46.16 Favored Pre-proline 0 CA--C 1.545 0.776 0 CA-C-O 117.989 -1.005 . . . . 0.0 113.328 -177.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.32 -1.73 8.61 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.097 2.531 . . . . 0.0 114.844 179.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.9 t -99.01 -54.69 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 126.212 1.805 . . . . 0.0 109.54 174.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.22 -45.59 80.18 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.766 0.827 . . . . 0.0 112.887 -178.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.26 -3.72 38.05 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -171.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.0 mt -54.36 -35.46 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 123.456 0.703 . . . . 0.0 110.507 171.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.4 p -109.32 158.34 17.98 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.761 1.224 . . . . 0.0 113.17 171.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -155.92 108.44 2.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.941 1.696 . . . . 0.0 110.561 177.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.01 1.48 86.71 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 124.533 1.063 . . . . 0.0 114.977 -178.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -75.1 119.88 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 124.932 1.293 . . . . 0.0 111.298 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.16 -13.05 11.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 126.624 1.97 . . . . 0.0 110.993 173.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.86 3.68 4.97 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 127.428 2.291 . . . . 0.0 116.46 -168.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 54.08 64.55 1.79 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.469 1.507 . . . . 0.0 112.601 -172.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -158.66 152.04 22.91 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 126.601 1.96 . . . . 0.0 110.486 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -136.63 -169.32 2.43 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.906 -1.121 . . . . 0.0 110.835 163.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 13.3 p -122.71 150.82 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 C-N-CA 125.314 1.446 . . . . 0.0 109.185 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.3 tp -50.91 138.91 18.18 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.841 0.856 . . . . 0.0 111.255 167.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.45 176.06 0.68 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.053 0.941 . . . . 0.0 111.679 173.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -117.65 -26.99 6.4 Favored 'General case' 0 N--CA 1.482 1.161 0 O-C-N 120.788 -1.195 . . . . 0.0 113.936 178.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -87.9 169.32 12.12 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.394 1.477 . . . . 0.0 112.38 -174.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -114.3 103.53 11.17 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.051 -1.031 . . . . 0.0 111.667 -174.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -98.96 158.42 15.66 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 126.172 1.789 . . . . 0.0 110.422 -176.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -70.93 106.54 3.68 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.763 -0.586 . . . . 0.0 110.549 176.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -95.56 123.2 38.99 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.202 1.001 . . . . 0.0 111.662 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.6 t -123.19 88.51 2.94 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 125.903 1.681 . . . . 0.0 110.927 -174.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -81.19 162.64 23.52 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.785 0.802 . . . . 0.0 111.693 168.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -152.26 127.87 10.09 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 125.104 1.362 . . . . 0.0 108.251 162.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -119.96 137.46 54.05 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.801 1.24 . . . . 0.0 110.001 -173.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.6 t -61.52 148.14 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 CA-C-O 121.514 0.673 . . . . 0.0 112.365 -177.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.9 t -137.18 94.39 2.94 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.081 1.352 . . . . 0.0 110.996 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.0 t . . . . . 0 C--O 1.255 1.345 0 C-N-CA 126.171 1.788 . . . . 0.0 112.506 178.558 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -74.21 -46.78 0.28 Allowed 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 121.732 1.621 . . . . 0.0 113.107 -167.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.12 171.91 13.84 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.91 2.084 . . . . 0.0 109.619 -177.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -102.33 129.7 48.85 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.285 1.034 . . . . 0.0 110.31 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -133.31 156.26 47.93 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.957 1.303 . . . . 0.0 111.871 -179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.97 151.98 20.72 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.074 1.35 . . . . 0.0 112.457 175.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -74.6 120.96 20.86 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.713 1.605 . . . . 0.0 111.805 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -142.24 116.12 9.29 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 125.927 1.691 . . . . 0.0 110.207 174.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.4 mmtt -133.22 147.43 51.99 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.924 1.69 . . . . 0.0 111.002 177.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.7 t -154.51 175.23 13.86 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.544 1.538 . . . . 0.0 111.549 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -139.41 101.19 4.18 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 124.473 1.109 . . . . 0.0 110.318 171.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -162.02 179.54 7.91 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.592 1.157 . . . . 0.0 113.52 -179.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.1 170.98 10.39 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 128.336 2.654 . . . . 0.0 113.732 174.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -142.35 141.3 32.31 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.06 1.744 . . . . 0.0 112.008 -176.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.6 t -102.09 142.66 33.0 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 122.038 0.923 . . . . 0.0 111.619 175.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.532 HG23 HD22 ' A' ' 104' ' ' ASN . 14.4 m -147.24 -178.7 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.559 1.944 . . . . 0.0 111.241 -175.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.0 m -125.72 117.71 24.05 Favored 'General case' 0 N--CA 1.482 1.162 0 O-C-N 121.177 -0.952 . . . . 0.0 111.525 174.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.09 131.51 34.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.783 0.833 . . . . 0.0 111.413 174.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -140.32 111.44 7.08 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 125.126 1.37 . . . . 0.0 108.562 179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 59.9 56.79 3.33 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 125.409 1.484 . . . . 0.0 112.456 -169.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.41 24.66 13.24 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 127.723 2.409 . . . . 0.0 115.102 169.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.66 133.05 5.69 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 125.142 1.377 . . . . 0.0 109.445 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -76.42 105.55 2.1 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 123.874 3.05 . . . . 0.0 112.469 -179.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.429 HG12 ' N ' ' A' ' 51' ' ' TRP . 5.7 m -101.96 15.46 5.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 125.714 1.606 . . . . 0.0 112.102 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 16.6 t-80 -156.79 146.45 20.73 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 120.216 1.371 . . . . 0.0 112.759 -175.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -101.12 135.62 42.3 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.601 1.16 . . . . 0.0 111.391 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 99.6 t -110.16 -53.7 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 124.016 0.926 . . . . 0.0 112.018 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.53 -174.23 45.35 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 119.006 0.821 . . . . 0.0 114.459 -174.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.4 t -123.54 127.62 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 125.477 1.511 . . . . 0.0 109.511 -176.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.82 4.51 7.34 Favored Glycine 0 CA--C 1.542 1.777 0 N-CA-C 116.376 1.311 . . . . 0.0 116.376 -176.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.3 t -167.87 160.82 12.65 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 127.269 2.228 . . . . 0.0 111.111 -175.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 86.9 m -108.27 107.74 18.46 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.222 1.809 . . . . 0.0 110.998 172.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.28 67.77 3.56 Favored Glycine 0 CA--C 1.534 1.225 0 C-N-CA 124.921 1.248 . . . . 0.0 113.785 -176.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.6 t -69.37 157.18 37.54 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.599 1.16 . . . . 0.0 112.589 174.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 65.87 -168.99 31.56 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 125.259 1.409 . . . . 0.0 115.066 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 125.51 -99.35 0.56 Allowed Glycine 0 CA--C 1.533 1.172 0 C-N-CA 125.741 1.639 . . . . 0.0 113.283 173.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.9 p -147.58 165.77 29.35 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.706 1.602 . . . . 0.0 112.594 -174.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.09 48.98 3.67 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 126.013 1.768 . . . . 0.0 115.411 -171.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 37.6 mm -75.0 145.44 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 C-N-CA 125.655 1.582 . . . . 0.0 110.992 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 25.7 p90 -138.28 7.68 2.64 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.893 1.677 . . . . 0.0 113.66 -178.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 85.1 mt -73.16 -13.15 61.11 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.002 1.721 . . . . 0.0 113.298 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -67.12 165.25 16.28 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.467 1.507 . . . . 0.0 113.376 179.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 49.2 m -68.1 -33.94 75.47 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.805 0.842 . . . . 0.0 111.967 174.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.8 t 46.45 59.36 3.9 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.418 1.887 . . . . 0.0 113.544 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -55.25 -15.85 2.77 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.03 1.732 . . . . 0.0 115.017 -177.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 29.3 t -53.5 -31.69 47.12 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.989 1.716 . . . . 0.0 113.633 166.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.19 111.22 15.63 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.77 1.628 . . . . 0.0 111.111 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 89.92 5.02 71.49 Favored Glycine 0 CA--C 1.539 1.579 0 C-N-CA 124.539 1.066 . . . . 0.0 115.205 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.01 -167.25 2.18 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.219 1.408 . . . . 0.0 111.343 172.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -153.48 172.77 16.62 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.762 1.625 . . . . 0.0 110.126 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.429 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -56.24 -37.95 70.45 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.613 1.965 . . . . 0.0 111.875 166.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.1 90.29 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.941 1.297 . . . . 0.0 111.797 -178.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.6 p -83.1 -30.84 27.64 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.316 1.446 . . . . 0.0 113.411 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -53.27 -38.68 63.29 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.68 1.592 . . . . 0.0 113.111 176.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -59.29 -62.73 1.67 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.744 0.818 . . . . 0.0 110.702 171.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -58.62 -23.94 59.98 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.1 tpmt? -64.35 -48.06 76.95 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 126.376 1.87 . . . . 0.0 113.257 177.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -155.15 25.19 0.42 Allowed 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.688 1.736 . . . . 0.0 115.688 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.3 mt -128.8 147.78 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 O-C-N 120.111 -1.618 . . . . 0.0 109.612 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.3 t -146.99 159.38 43.63 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -96.46 4.1 52.35 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 126.626 1.97 . . . . 0.0 112.494 168.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.0 t -161.98 115.76 1.85 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.305 1.842 . . . . 0.0 110.898 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.2 ttp-105 -67.36 106.2 2.01 Favored 'General case' 0 N--CA 1.475 0.806 0 O-C-N 120.574 -1.329 . . . . 0.0 110.724 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -115.51 3.56 14.07 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.293 1.437 . . . . 0.0 113.567 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 p -72.18 143.51 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 124.708 1.203 . . . . 0.0 112.368 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -130.38 6.54 4.87 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 126.06 1.744 . . . . 0.0 112.782 170.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 13.6 m 51.5 38.62 22.63 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 127.843 2.457 . . . . 0.0 113.962 -177.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -154.67 -27.76 0.12 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.112 2.565 . . . . 0.0 112.895 -178.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -107.61 1.69 23.42 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.771 1.629 . . . . 0.0 113.527 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.2 pt -59.86 -13.46 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.43 1.492 . . . . 0.0 113.662 176.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -53.77 -26.05 21.82 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.065 1.346 . . . . 0.0 114.259 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -91.3 -13.23 32.99 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.082 1.353 . . . . 0.0 113.645 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.6 p -93.45 -176.0 3.97 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.792 1.637 . . . . 0.0 112.051 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.5 m-80 -64.19 -18.39 64.45 Favored 'General case' 0 CA--C 1.548 0.884 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 169.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -93.16 11.36 28.07 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.011 1.724 . . . . 0.0 114.261 -167.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -64.98 -6.33 8.3 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 128.764 2.825 . . . . 0.0 115.01 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -62.35 -2.39 1.01 Allowed 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.845 2.058 . . . . 0.0 114.805 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.7 t 53.84 34.04 18.41 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 126.456 1.902 . . . . 0.0 113.874 -175.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.65 155.63 12.24 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.881 1.672 . . . . 0.0 112.242 174.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -71.13 -26.67 63.11 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -171.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.4 pttt -164.82 165.83 20.22 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.783 1.633 . . . . 0.0 112.236 167.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.5 t30 -137.41 163.65 30.55 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.199 1.0 . . . . 0.0 111.554 166.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.0 m -127.76 92.1 3.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.275 1.43 . . . . 0.0 110.0 175.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -76.56 122.86 25.21 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.774 0.83 . . . . 0.0 110.848 175.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 90.9 mt -99.59 116.23 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 125.035 1.334 . . . . 0.0 107.812 174.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -89.37 87.35 7.07 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.313 0.578 . . . . 0.0 110.539 169.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 93.8 p -148.94 166.39 28.75 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.136 1.375 . . . . 0.0 112.602 171.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 30.1 mtt85 -74.17 161.72 77.08 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 124.715 1.206 . . . . 0.0 111.528 170.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.51 -22.32 38.8 Favored 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 122.305 2.003 . . . . 0.0 114.457 177.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.65 -58.01 17.04 Favored Pre-proline 0 N--CA 1.473 0.72 0 CA-C-N 119.605 1.093 . . . . 0.0 112.714 -178.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -67.77 -0.57 5.49 Favored 'Trans proline' 0 C--N 1.354 0.823 0 C-N-CA 123.138 2.559 . . . . 0.0 114.94 178.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.4 t -101.14 -55.56 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 C-N-CA 126.426 1.89 . . . . 0.0 109.7 174.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -45.53 81.26 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.087 -1.008 . . . . 0.0 112.971 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.59 -2.9 31.35 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -172.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.3 mt -53.44 -35.63 25.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.664 0.786 . . . . 0.0 110.468 169.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.5 p -110.38 159.23 17.65 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.63 1.172 . . . . 0.0 113.235 174.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -156.44 103.11 2.12 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.162 1.785 . . . . 0.0 110.005 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 87.5 3.55 81.17 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.596 1.093 . . . . 0.0 114.961 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.4 mt -75.31 116.48 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 118.63 1.215 . . . . 0.0 111.241 -178.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.4 mt -110.37 -13.44 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.516 1.926 . . . . 0.0 111.079 173.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -71.74 2.62 5.07 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 127.38 2.272 . . . . 0.0 116.298 -170.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.6 t 52.27 67.58 0.95 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.79 1.636 . . . . 0.0 112.507 -170.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -155.14 156.47 35.81 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.646 1.978 . . . . 0.0 110.878 177.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.532 HD22 HG23 ' A' ' 16' ' ' VAL . 6.1 t-20 -140.72 -171.93 3.34 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.752 -1.218 . . . . 0.0 111.702 162.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.0 t -123.78 139.85 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.647 1.579 . . . . 0.0 108.452 172.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 34.0 tp -48.44 140.31 8.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.624 1.17 . . . . 0.0 111.893 170.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.45 174.06 0.81 Allowed 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 174.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.5 t -122.48 -21.59 5.71 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.803 1.241 . . . . 0.0 114.201 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.8 m -86.25 171.47 11.23 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.25 1.42 . . . . 0.0 111.765 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -119.01 109.85 16.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 124.107 0.963 . . . . 0.0 111.26 -176.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -105.09 159.93 15.45 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.014 1.726 . . . . 0.0 110.295 -173.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -68.74 108.83 3.56 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.153 0.502 . . . . 0.0 110.35 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.91 121.28 41.09 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.347 1.459 . . . . 0.0 111.202 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.6 t -125.25 90.44 3.23 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 125.106 1.363 . . . . 0.0 110.717 -174.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -80.97 161.09 24.44 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 123.547 0.739 . . . . 0.0 110.864 170.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -150.44 134.71 17.09 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 120.937 -1.102 . . . . 0.0 108.185 156.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -125.99 141.03 52.14 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.051 1.34 . . . . 0.0 109.228 -174.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.5 t -63.36 148.96 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-O 121.701 0.763 . . . . 0.0 112.114 -177.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 13.3 t -139.68 85.94 2.07 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.955 1.302 . . . . 0.0 111.874 176.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.252 1.198 0 C-N-CA 126.533 1.933 . . . . 0.0 113.709 178.633 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.453 0 CA-C-O 118.606 -0.712 . . . . 0.0 111.378 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.98 -47.53 1.77 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 122.138 1.892 . . . . 0.0 112.263 175.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -138.98 176.14 8.94 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.308 1.843 . . . . 0.0 110.353 -177.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -95.27 127.34 41.24 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.568 1.147 . . . . 0.0 110.2 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -135.39 159.25 42.16 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.563 1.145 . . . . 0.0 111.957 178.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.33 151.68 25.67 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.907 1.683 . . . . 0.0 112.722 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.63 110.22 12.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 126.204 1.802 . . . . 0.0 111.742 -172.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -134.11 117.7 16.88 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.587 1.555 . . . . 0.0 111.372 177.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -132.35 151.6 51.79 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.806 1.643 . . . . 0.0 111.406 173.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -152.75 177.04 11.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.114 1.366 . . . . 0.0 112.012 176.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -144.41 103.98 4.03 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.044 0.938 . . . . 0.0 111.058 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.58 172.6 6.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.375 1.47 . . . . 0.0 113.224 -173.269 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.12 171.86 1.19 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 127.585 2.354 . . . . 0.0 114.355 168.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -142.65 146.27 34.3 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.559 1.944 . . . . 0.0 111.597 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 19.0 t -106.5 142.46 36.13 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.088 0.955 . . . . 0.0 111.63 177.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.8 m -147.14 -179.53 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.471 1.908 . . . . 0.0 111.697 -174.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.42 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.7 m -126.42 119.81 28.18 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 121.225 -0.922 . . . . 0.0 111.818 174.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.4 t -85.17 128.83 34.82 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.34 1.056 . . . . 0.0 111.341 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -136.5 113.31 10.3 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.023 1.329 . . . . 0.0 108.988 176.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 58.27 57.83 3.76 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.985 1.314 . . . . 0.0 112.453 -172.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.98 26.25 14.08 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 127.398 2.279 . . . . 0.0 114.763 170.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.53 134.16 5.96 Favored Pre-proline 0 CA--C 1.544 0.712 0 C-N-CA 124.94 1.296 . . . . 0.0 109.516 -177.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -75.32 105.46 2.09 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 123.698 2.932 . . . . 0.0 112.228 177.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.437 HG12 ' H ' ' A' ' 51' ' ' TRP . 9.9 m -99.41 11.8 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 125.26 1.424 . . . . 0.0 111.968 -179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.42 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 21.5 t-80 -155.75 142.25 18.63 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.114 1.325 . . . . 0.0 112.595 -170.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -98.02 137.6 36.59 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.391 1.076 . . . . 0.0 111.351 175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 72.6 t -111.3 -55.49 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.133 0.973 . . . . 0.0 112.028 177.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.57 -173.65 43.24 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 118.983 0.811 . . . . 0.0 115.123 -171.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.9 t -127.54 124.03 62.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 125.874 1.67 . . . . 0.0 110.051 -172.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.04 3.96 10.08 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -175.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.0 p -168.96 163.98 11.47 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 127.647 2.379 . . . . 0.0 110.924 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -105.44 106.43 16.93 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.112 1.365 . . . . 0.0 110.611 172.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -97.15 90.81 1.15 Allowed Glycine 0 CA--C 1.531 1.058 0 C-N-CA 125.436 1.493 . . . . 0.0 112.011 -178.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 t -125.24 168.05 14.01 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.044 1.338 . . . . 0.0 112.398 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.76 -176.42 45.91 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 125.395 1.474 . . . . 0.0 114.068 -172.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 116.33 -85.11 0.38 Allowed Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.579 1.561 . . . . 0.0 113.126 175.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 52.5 m -140.92 166.23 25.34 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.481 1.512 . . . . 0.0 112.493 -174.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -77.93 45.5 2.5 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 126.027 1.775 . . . . 0.0 114.76 -178.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.3 mt -70.38 142.74 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 126.06 1.744 . . . . 0.0 110.145 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 19.5 p90 -135.91 6.66 3.16 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.699 1.6 . . . . 0.0 113.725 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.4 -8.53 55.47 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.835 1.654 . . . . 0.0 112.643 178.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -59.56 167.92 1.81 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.493 1.917 . . . . 0.0 112.787 168.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.3 m -70.02 -27.19 64.47 Favored 'General case' 0 N--CA 1.477 0.893 0 O-C-N 121.417 -0.802 . . . . 0.0 112.633 178.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 91.8 p 51.26 38.86 22.51 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.533 1.933 . . . . 0.0 115.298 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.09 -24.03 9.21 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.081 1.352 . . . . 0.0 114.315 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.9 p -52.62 -31.95 39.27 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 126.562 1.945 . . . . 0.0 114.765 171.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.98 104.44 8.57 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.018 1.727 . . . . 0.0 111.919 176.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.35 -3.8 50.98 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 125.484 1.516 . . . . 0.0 115.245 178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.4 m -131.67 -163.58 1.35 Allowed 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.261 1.424 . . . . 0.0 111.134 172.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -156.1 173.39 16.89 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.926 1.691 . . . . 0.0 109.687 -175.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.437 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.4 t-105 -55.45 -37.94 68.4 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.705 2.002 . . . . 0.0 112.063 167.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -42.34 83.38 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.827 1.251 . . . . 0.0 111.329 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -87.82 -27.57 22.19 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.568 1.547 . . . . 0.0 114.084 175.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -50.48 -42.86 55.1 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.934 1.694 . . . . 0.0 112.782 173.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.67 -62.45 1.72 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.454 1.102 . . . . 0.0 110.797 173.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.6 mttp -60.31 -23.03 63.88 Favored 'General case' 0 N--CA 1.483 1.195 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 -178.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -64.57 -52.58 56.89 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.34 1.456 . . . . 0.0 113.163 178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -149.95 22.64 0.87 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.357 1.614 . . . . 0.0 115.357 -175.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -125.69 150.08 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 120.362 -1.461 . . . . 0.0 109.246 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.6 t -145.39 152.58 40.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 176.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -84.31 -1.81 55.97 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.156 1.782 . . . . 0.0 112.963 168.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.2 t -163.65 114.71 1.37 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.391 1.876 . . . . 0.0 111.178 176.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.2 ttp-105 -66.59 105.87 1.64 Allowed 'General case' 0 N--CA 1.476 0.859 0 O-C-N 120.348 -1.47 . . . . 0.0 110.683 173.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -115.18 1.29 13.81 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 125.275 1.43 . . . . 0.0 113.595 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.435 HG22 ' H ' ' A' ' 67' ' ' CYS . 7.7 p -72.3 143.04 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.675 0 C-N-CA 124.818 1.247 . . . . 0.0 112.229 178.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -130.77 12.66 5.31 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 126.123 1.769 . . . . 0.0 112.226 170.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.435 ' H ' HG22 ' A' ' 65' ' ' VAL . 6.4 m 51.67 38.41 22.67 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.905 2.482 . . . . 0.0 112.704 -173.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -147.86 -43.01 0.16 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.808 2.443 . . . . 0.0 112.519 -168.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.4 p30 -93.0 -6.26 48.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.141 1.377 . . . . 0.0 113.347 -178.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.9 pt -63.34 -10.78 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.509 1.124 . . . . 0.0 113.492 -178.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -56.38 -19.78 16.38 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.887 1.275 . . . . 0.0 114.128 164.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.3 t -114.76 -2.33 13.02 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.425 1.89 . . . . 0.0 113.78 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 29.5 p -98.52 -174.37 2.79 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.122 1.369 . . . . 0.0 110.886 172.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -64.02 -18.08 63.97 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 120.801 -1.187 . . . . 0.0 113.622 173.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -94.53 14.03 22.12 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.867 1.667 . . . . 0.0 114.275 -165.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -66.32 -4.16 7.39 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 128.514 2.726 . . . . 0.0 114.922 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -62.96 -2.9 1.36 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.651 1.98 . . . . 0.0 115.16 -174.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.8 t 57.17 32.26 21.41 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.938 1.695 . . . . 0.0 113.596 -176.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.21 155.27 25.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.103 1.361 . . . . 0.0 112.334 179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -64.62 -30.99 72.02 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -170.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -164.25 164.17 22.54 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.015 1.726 . . . . 0.0 111.407 166.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -128.78 159.26 36.25 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.184 0.593 . . . . 0.0 110.159 161.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 88.1 m -122.05 93.51 4.01 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.828 1.251 . . . . 0.0 109.578 173.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -78.25 128.0 33.08 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.563 0.745 . . . . 0.0 111.114 176.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.1 mt -103.4 111.77 34.38 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 C-N-CA 125.385 1.474 . . . . 0.0 107.447 173.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -80.62 88.83 5.69 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.728 -0.608 . . . . 0.0 109.69 168.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 71.1 m -149.21 159.31 44.36 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.069 1.348 . . . . 0.0 112.849 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -73.39 162.75 72.88 Favored Pre-proline 0 N--CA 1.474 0.766 0 C-N-CA 124.641 1.176 . . . . 0.0 110.35 166.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.8 -23.13 30.97 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 122.135 1.89 . . . . 0.0 114.428 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -61.97 -56.84 27.99 Favored Pre-proline 0 N--CA 1.474 0.744 0 CA-C-O 117.974 -1.013 . . . . 0.0 113.183 -176.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.69 -1.12 7.87 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.982 2.455 . . . . 0.0 114.863 179.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.2 t -100.81 -54.32 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 126.282 1.833 . . . . 0.0 109.668 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -44.79 79.41 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.225 -0.922 . . . . 0.0 112.969 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.25 -4.2 37.62 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 -172.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.7 mt -53.08 -35.22 22.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.876 0.87 . . . . 0.0 110.799 170.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.6 p -112.53 158.07 20.38 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.271 1.429 . . . . 0.0 113.315 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 12.9 tmtt? -154.83 107.79 2.81 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.56 1.944 . . . . 0.0 109.803 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.56 3.24 88.51 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 124.411 1.005 . . . . 0.0 114.957 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 51.1 mt -76.43 117.62 21.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.887 1.275 . . . . 0.0 111.037 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 mt -111.98 -12.04 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 126.729 2.012 . . . . 0.0 110.964 173.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 3.7 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 127.325 2.25 . . . . 0.0 116.12 -170.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.26 67.93 0.9 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.736 1.614 . . . . 0.0 113.062 -171.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 31.8 tttm -158.53 153.56 25.25 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.164 1.786 . . . . 0.0 110.717 177.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -138.46 -170.91 2.93 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.822 -1.174 . . . . 0.0 111.128 165.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.0 t -125.59 139.85 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 C-N-CA 125.431 1.492 . . . . 0.0 108.578 173.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.0 tp -48.77 139.72 9.43 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.502 1.121 . . . . 0.0 111.947 170.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.25 172.33 1.51 Allowed 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 174.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -120.09 -24.47 6.01 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.701 1.201 . . . . 0.0 113.996 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 51.0 m -82.07 172.68 12.94 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.233 1.413 . . . . 0.0 112.089 175.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -119.16 105.36 11.3 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.595 1.158 . . . . 0.0 111.382 -177.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -100.61 162.29 13.03 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.0 1.72 . . . . 0.0 110.854 -174.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -73.49 105.37 4.81 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.759 -0.588 . . . . 0.0 110.506 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.83 123.09 39.25 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.741 1.216 . . . . 0.0 111.471 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 42.4 t -127.05 91.2 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 125.006 1.322 . . . . 0.0 110.892 -174.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -83.95 164.39 19.41 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 121.682 0.753 . . . . 0.0 111.591 169.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -154.2 119.87 5.21 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 121.192 -0.943 . . . . 0.0 109.025 161.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -107.66 139.46 42.17 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.325 1.05 . . . . 0.0 110.239 -174.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.14 149.55 9.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.174 0.589 . . . . 0.0 112.198 179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.1 t -142.14 95.06 2.74 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-O 122.099 0.952 . . . . 0.0 112.667 175.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 126.864 2.066 . . . . 0.0 113.952 179.127 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 34.0 ttm180 . . . . . 0 N--CA 1.488 1.438 0 CA-C-O 118.856 -0.592 . . . . 0.0 111.767 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.45 -47.33 0.24 Allowed 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.594 1.53 . . . . 0.0 111.989 169.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -144.84 -178.11 5.86 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.774 2.029 . . . . 0.0 110.742 -174.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -105.45 127.08 52.8 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.352 1.461 . . . . 0.0 110.418 177.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -134.34 164.29 27.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.888 1.275 . . . . 0.0 112.23 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.9 ptmt -116.04 153.29 31.95 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.793 2.037 . . . . 0.0 112.646 -179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -85.33 113.99 22.07 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.475 1.91 . . . . 0.0 111.577 -168.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -137.87 103.06 4.88 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.641 1.576 . . . . 0.0 112.424 178.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -117.35 140.98 48.88 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.079 1.351 . . . . 0.0 111.279 177.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.7 m -147.2 165.68 29.3 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.648 1.579 . . . . 0.0 111.484 -174.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.7 m -140.21 103.67 4.64 Favored 'General case' 0 N--CA 1.475 0.798 0 O-C-N 121.614 -0.679 . . . . 0.0 111.209 177.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.48 170.7 5.72 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.803 1.241 . . . . 0.0 113.248 -169.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 171.62 1.45 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 127.571 2.349 . . . . 0.0 113.89 168.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.5 p90 -141.83 147.0 36.51 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.336 1.854 . . . . 0.0 111.453 179.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 16.6 t -105.45 144.31 32.39 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.839 0.856 . . . . 0.0 111.063 176.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 17.8 m -148.36 -178.04 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 126.336 1.855 . . . . 0.0 111.804 -175.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.7 m -128.09 117.66 22.03 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.022 1.329 . . . . 0.0 111.877 176.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 18.7 t -85.32 129.43 34.81 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.467 1.107 . . . . 0.0 111.729 177.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -135.61 114.1 11.68 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 125.021 1.329 . . . . 0.0 109.113 175.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 57.46 57.25 4.48 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.876 1.27 . . . . 0.0 112.445 -172.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 64.4 26.18 13.5 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.458 2.303 . . . . 0.0 114.745 170.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.01 134.29 5.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 125.111 1.365 . . . . 0.0 109.709 -177.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -75.55 110.08 3.03 Favored 'Trans proline' 0 CA--C 1.537 0.662 0 C-N-CA 123.551 2.834 . . . . 0.0 113.351 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.457 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.4 m -108.01 17.03 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 126.42 1.888 . . . . 0.0 112.347 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -153.8 141.3 19.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.66 -1.275 . . . . 0.0 111.113 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -84.69 154.23 22.6 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.124 0.57 . . . . 0.0 110.274 169.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.1 t -130.1 -44.6 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 173.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.04 -174.96 47.23 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 119.74 1.155 . . . . 0.0 115.262 -174.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 29.3 t -130.79 116.67 35.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.03 1.732 . . . . 0.0 110.024 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.34 3.29 31.06 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 115.17 0.828 . . . . 0.0 115.17 -174.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 98.4 p -167.9 167.6 12.75 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 128.156 2.582 . . . . 0.0 110.387 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 78.4 m -107.2 119.82 40.44 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.256 1.422 . . . . 0.0 110.34 171.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -66.12 114.5 6.61 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 124.816 1.198 . . . . 0.0 112.042 174.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.6 p -61.39 138.57 58.26 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.779 1.632 . . . . 0.0 112.937 179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -81.79 36.46 2.49 Favored Glycine 0 CA--C 1.536 1.392 0 C-N-CA 125.648 1.594 . . . . 0.0 115.258 -173.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -78.81 -63.79 2.04 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.932 1.253 . . . . 0.0 113.446 -176.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 30.8 m -67.71 160.16 28.64 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.004 1.322 . . . . 0.0 113.323 -177.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.84 19.12 12.54 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 125.838 1.685 . . . . 0.0 116.046 -176.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 53.0 mt -63.22 133.79 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 125.641 1.576 . . . . 0.0 110.704 -175.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -145.36 20.53 1.54 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.542 1.537 . . . . 0.0 113.272 -178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.51 -11.96 60.13 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.589 -1.319 . . . . 0.0 112.866 -177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -68.11 167.62 13.69 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.844 1.657 . . . . 0.0 113.482 177.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 50.2 m -64.23 -34.17 77.48 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.357 1.063 . . . . 0.0 112.432 176.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.9 t 43.47 71.89 0.21 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.658 2.383 . . . . 0.0 114.363 -176.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.5 mp -67.6 2.8 1.63 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 126.062 1.745 . . . . 0.0 115.061 -178.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.2 t -60.96 -39.09 88.23 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.242 1.417 . . . . 0.0 113.103 177.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.05 113.69 18.09 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.243 1.417 . . . . 0.0 110.805 -175.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.54 0.8 64.5 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.922 1.248 . . . . 0.0 115.076 -177.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 18.1 m -138.36 -172.12 3.21 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.233 1.413 . . . . 0.0 111.202 175.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -153.93 173.25 16.21 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.794 1.638 . . . . 0.0 109.663 -175.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.457 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -56.48 -37.41 70.32 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 126.076 1.751 . . . . 0.0 111.734 168.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.63 -37.62 76.31 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.486 1.114 . . . . 0.0 111.731 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -90.94 -27.1 18.93 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.599 1.16 . . . . 0.0 113.926 175.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -51.07 -43.01 60.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 126.136 1.774 . . . . 0.0 113.036 174.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -56.4 -62.21 1.88 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.507 1.123 . . . . 0.0 110.961 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.59 -27.49 62.76 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.8 tptt -65.11 -51.02 63.74 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.019 1.328 . . . . 0.0 113.726 -176.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -148.84 22.82 0.99 Allowed 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.2 mt -128.3 147.94 32.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 125.11 1.364 . . . . 0.0 109.434 178.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.4 t -147.88 154.36 40.3 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -85.65 1.51 48.97 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.21 1.804 . . . . 0.0 113.112 167.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.6 t -162.38 104.19 1.1 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.685 1.994 . . . . 0.0 110.953 176.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.8 ttm180 -67.33 109.06 2.98 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.546 -1.346 . . . . 0.0 110.121 173.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.81 5.69 17.64 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.305 1.442 . . . . 0.0 113.005 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.4 t -77.2 139.3 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.871 1.268 . . . . 0.0 111.898 -174.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -127.36 7.86 6.47 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 126.096 1.758 . . . . 0.0 112.819 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 17.6 m 53.03 37.26 24.28 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 127.424 2.29 . . . . 0.0 113.816 -178.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -151.03 -33.36 0.16 Allowed 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.831 2.452 . . . . 0.0 111.853 -177.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -97.52 -5.25 36.26 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.852 1.661 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.7 pt -62.32 -12.21 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.947 1.299 . . . . 0.0 113.633 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -55.68 -33.39 64.09 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.738 0.815 . . . . 0.0 112.387 168.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.1 t -77.54 -12.57 59.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.263 1.425 . . . . 0.0 114.207 176.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -100.49 -175.36 2.89 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.539 1.536 . . . . 0.0 112.422 -175.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -63.34 -19.95 65.08 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 170.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -94.25 12.79 25.55 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.783 1.633 . . . . 0.0 114.199 -165.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.2 p90 -64.68 -5.79 6.47 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 128.999 2.919 . . . . 0.0 115.136 -176.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -62.32 -2.06 0.91 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.739 2.016 . . . . 0.0 114.919 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.8 t 55.98 31.46 18.0 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 126.101 1.76 . . . . 0.0 113.981 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 156.81 24.37 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.847 1.659 . . . . 0.0 112.527 179.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -63.23 -34.13 76.99 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.654 1.182 . . . . 0.0 114.155 -171.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.4 ptmm? -162.64 160.57 25.87 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.913 1.685 . . . . 0.0 112.473 168.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -129.85 159.01 37.91 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 124.029 0.932 . . . . 0.0 110.152 161.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 63.9 m -123.7 92.73 3.74 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.164 1.386 . . . . 0.0 109.503 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -79.48 121.85 25.71 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.166 0.986 . . . . 0.0 111.168 179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.9 mt -97.25 117.25 41.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 C-N-CA 125.242 1.417 . . . . 0.0 107.897 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -89.05 90.81 8.57 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 121.249 0.547 . . . . 0.0 110.294 167.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 60.0 p -144.67 172.04 13.55 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.337 1.455 . . . . 0.0 112.311 172.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.4 mtp180 -79.3 164.27 55.2 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 124.434 1.094 . . . . 0.0 109.779 164.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 -22.88 22.03 Favored 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 122.179 1.92 . . . . 0.0 114.284 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -60.24 -54.97 49.92 Favored Pre-proline 0 CA--C 1.546 0.792 0 CA-C-O 118.018 -0.991 . . . . 0.0 113.293 -177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.95 -1.28 8.36 Favored 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 123.236 2.624 . . . . 0.0 114.785 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 15.7 t -99.7 -53.97 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 126.141 1.776 . . . . 0.0 109.708 175.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -45.37 78.83 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.36 -0.837 . . . . 0.0 112.869 -179.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.36 -3.54 37.42 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -171.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 53.3 mt -53.83 -36.19 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 123.514 0.726 . . . . 0.0 110.491 170.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.2 p -108.92 158.04 18.07 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.798 1.239 . . . . 0.0 113.031 171.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -156.2 104.84 2.27 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.657 1.583 . . . . 0.0 110.785 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 1.84 81.36 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 124.656 1.122 . . . . 0.0 115.002 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.7 mt -74.66 119.91 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.899 1.279 . . . . 0.0 111.237 -178.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.3 mt -112.27 -13.19 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.591 1.956 . . . . 0.0 110.927 173.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.93 4.14 5.77 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 127.441 2.296 . . . . 0.0 116.341 -168.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 53.2 68.16 0.88 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.646 1.579 . . . . 0.0 112.998 -171.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 30.3 ttmt -159.83 152.86 21.78 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 126.161 1.784 . . . . 0.0 110.907 -179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -141.65 -170.24 3.07 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.817 -1.177 . . . . 0.0 111.524 166.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.92 142.62 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.581 0 C-N-CA 125.747 1.619 . . . . 0.0 108.656 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.1 tp -51.12 140.66 15.7 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.229 1.011 . . . . 0.0 111.721 168.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.77 172.93 1.46 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 113.439 0.903 . . . . 0.0 113.439 173.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -118.42 -31.47 4.92 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.872 1.269 . . . . 0.0 113.354 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.5 m -74.3 170.54 15.39 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.701 1.601 . . . . 0.0 112.334 175.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -120.34 102.31 8.39 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.326 1.051 . . . . 0.0 111.601 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -95.27 161.57 14.04 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 126.081 1.752 . . . . 0.0 110.978 -175.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -74.63 101.35 4.22 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.726 0.81 . . . . 0.0 110.53 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -96.1 128.8 43.33 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.943 1.297 . . . . 0.0 112.3 -179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.9 t -129.6 96.09 4.17 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.783 1.633 . . . . 0.0 110.672 -173.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -94.17 157.34 16.11 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.845 0.831 . . . . 0.0 111.585 172.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -147.43 117.86 7.43 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.271 1.028 . . . . 0.0 109.474 167.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -106.36 138.12 43.11 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.632 1.173 . . . . 0.0 110.099 -178.125 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.9 t -61.15 146.92 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 123.673 0.789 . . . . 0.0 111.624 177.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 5.7 t -137.91 88.56 2.33 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-O 122.894 1.33 . . . . 0.0 111.39 174.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.7 m . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.343 1.857 . . . . 0.0 112.935 175.046 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -81.1 -51.05 0.05 OUTLIER 'Trans proline' 0 CA--C 1.545 1.071 0 C-N-CA 122.276 1.984 . . . . 0.0 114.453 -161.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 76.2 m -127.62 160.4 31.74 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.171 1.788 . . . . 0.0 109.782 169.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -88.0 140.55 29.38 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.509 1.124 . . . . 0.0 110.136 173.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -138.93 159.75 41.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.057 1.343 . . . . 0.0 112.32 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -92.67 156.22 17.21 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 127.144 2.178 . . . . 0.0 111.948 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -89.7 113.4 24.89 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 126.271 1.828 . . . . 0.0 111.128 178.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -137.16 93.06 2.78 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.884 1.274 . . . . 0.0 111.929 174.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -109.07 136.18 49.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.017 1.327 . . . . 0.0 110.758 177.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.9 m -143.46 171.46 14.11 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.591 1.556 . . . . 0.0 111.737 -174.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -143.54 104.68 4.25 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.137 -0.977 . . . . 0.0 111.439 175.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.52 172.72 4.97 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.112 1.365 . . . . 0.0 113.332 -169.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.37 173.42 1.57 Allowed 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 127.551 2.34 . . . . 0.0 114.233 168.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 12.8 p90 -142.88 147.53 35.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.759 2.024 . . . . 0.0 111.51 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -107.25 142.55 36.83 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.028 0.931 . . . . 0.0 111.501 176.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.534 HG23 HD22 ' A' ' 104' ' ' ASN . 16.1 m -147.98 -178.62 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 126.305 1.842 . . . . 0.0 111.65 -174.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.4 m -127.06 119.69 27.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.115 0.966 . . . . 0.0 111.195 174.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -87.73 132.73 34.03 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.708 0.803 . . . . 0.0 111.365 174.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -137.08 118.23 14.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.365 1.466 . . . . 0.0 108.488 174.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 56.37 55.44 6.61 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.65 1.18 . . . . 0.0 112.495 -171.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.54 25.16 11.78 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 127.675 2.39 . . . . 0.0 115.038 169.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.11 133.33 6.1 Favored Pre-proline 0 CA--C 1.543 0.673 0 C-N-CA 124.779 1.232 . . . . 0.0 109.439 -175.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -76.0 104.57 1.93 Allowed 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 123.848 3.032 . . . . 0.0 112.163 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.439 HG12 ' H ' ' A' ' 51' ' ' TRP . 7.7 m -102.05 14.59 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.394 1.478 . . . . 0.0 112.194 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.417 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 18.3 t-80 -156.59 142.59 18.0 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 120.111 1.323 . . . . 0.0 112.259 -173.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -97.58 141.19 30.92 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.258 1.023 . . . . 0.0 111.216 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 78.0 t -115.71 -53.86 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 C-N-CA 124.057 0.943 . . . . 0.0 112.208 177.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.8 -172.78 42.64 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-N 119.122 0.874 . . . . 0.0 115.089 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -128.5 122.25 57.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 126.006 1.722 . . . . 0.0 110.034 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.82 1.46 12.03 Favored Glycine 0 CA--C 1.541 1.672 0 N-CA-C 115.856 1.102 . . . . 0.0 115.856 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.6 t -169.08 164.63 11.29 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 127.879 2.472 . . . . 0.0 110.316 -176.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.6 m -104.58 111.54 24.26 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.841 1.657 . . . . 0.0 111.174 173.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.63 80.51 1.44 Allowed Glycine 0 CA--C 1.532 1.11 0 C-N-CA 125.101 1.334 . . . . 0.0 112.732 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 t -64.36 120.49 12.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.557 1.143 . . . . 0.0 111.659 174.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.8 -168.13 40.56 Favored Glycine 0 CA--C 1.539 1.585 0 C-N-CA 124.324 0.964 . . . . 0.0 114.329 -177.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 161.56 -99.37 0.17 Allowed Glycine 0 CA--C 1.531 1.093 0 C-N-CA 124.683 1.135 . . . . 0.0 112.364 176.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.1 m -138.85 159.42 42.17 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.857 1.663 . . . . 0.0 111.436 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.37 40.97 2.23 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 125.602 1.572 . . . . 0.0 115.029 -175.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 25.1 mm -89.94 157.81 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.909 1.684 . . . . 0.0 110.687 -175.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -138.01 8.07 2.72 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.171 1.388 . . . . 0.0 114.197 -173.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.9 -11.45 60.0 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.065 1.346 . . . . 0.0 112.507 -178.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -64.69 164.15 12.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.577 1.151 . . . . 0.0 112.195 169.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.5 m -68.22 -33.79 75.05 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 121.623 -0.673 . . . . 0.0 112.168 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.5 t 48.61 59.54 4.29 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 126.222 1.809 . . . . 0.0 112.827 -178.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mp -60.83 -13.1 13.26 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -172.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.8 p -58.22 -30.48 66.52 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 126.062 1.745 . . . . 0.0 114.469 172.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -122.74 122.5 38.89 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.856 1.662 . . . . 0.0 111.841 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 78.21 14.17 82.53 Favored Glycine 0 CA--C 1.537 1.44 0 C-N-CA 124.11 0.862 . . . . 0.0 115.02 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.6 m -152.01 -178.33 6.69 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 126.926 2.09 . . . . 0.0 110.088 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -152.0 167.62 27.84 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.883 2.073 . . . . 0.0 110.702 -168.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.439 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.8 t-105 -54.74 -36.69 65.04 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.427 1.891 . . . . 0.0 112.41 170.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.71 -26.97 68.6 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.753 1.221 . . . . 0.0 113.06 178.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.7 p -89.43 -31.6 17.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.658 1.183 . . . . 0.0 113.649 167.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.01 -39.69 72.28 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.89 1.676 . . . . 0.0 113.11 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -57.42 -65.43 0.63 Allowed 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 124.435 1.094 . . . . 0.0 110.526 172.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -60.67 -22.33 63.78 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -61.73 -55.09 33.95 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.465 1.506 . . . . 0.0 113.329 177.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.7 p80 -147.88 21.96 1.12 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 -172.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.0 mt -129.22 146.84 33.61 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.095 1.358 . . . . 0.0 109.695 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.9 t -147.35 153.82 40.15 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 174.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.8 p30 -84.73 0.86 49.05 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.088 1.755 . . . . 0.0 113.112 168.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.2 t -161.26 105.76 1.32 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.529 1.932 . . . . 0.0 110.932 175.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 -66.99 108.34 2.56 Favored 'General case' 0 N--CA 1.474 0.739 0 O-C-N 120.545 -1.347 . . . . 0.0 110.13 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -114.44 4.38 15.27 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.328 1.451 . . . . 0.0 113.026 176.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 87.4 t -83.4 138.04 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 C-N-CA 124.133 0.973 . . . . 0.0 111.437 -174.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -124.55 8.61 8.33 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.127 1.771 . . . . 0.0 112.398 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.3 m 52.03 44.64 29.37 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.385 2.274 . . . . 0.0 113.26 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -160.55 -20.07 0.06 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 127.201 2.2 . . . . 0.0 113.718 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -106.39 -1.98 22.66 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.826 1.25 . . . . 0.0 113.671 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.45 -13.72 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 125.434 1.493 . . . . 0.0 114.195 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 4.6 ptm -51.07 -25.11 4.53 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.23 1.412 . . . . 0.0 114.587 164.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.6 t -95.66 -15.58 22.62 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.663 1.585 . . . . 0.0 113.584 177.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 p -90.39 -174.73 4.25 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.698 1.599 . . . . 0.0 112.188 -178.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -63.38 -20.73 65.79 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 121.146 -0.971 . . . . 0.0 113.572 168.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.27 20.01 8.7 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.606 1.963 . . . . 0.0 113.424 -170.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -65.59 -10.12 32.72 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.601 2.36 . . . . 0.0 114.537 -174.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -61.8 -3.13 1.01 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.89 2.476 . . . . 0.0 115.369 -175.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.93 25.47 6.83 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.296 1.838 . . . . 0.0 114.185 -177.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 161.3 4.27 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 113.692 -177.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -63.98 -34.81 78.84 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.472 1.509 . . . . 0.0 114.346 -168.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -165.35 158.53 16.25 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.446 1.498 . . . . 0.0 112.421 175.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -140.43 128.23 21.83 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.797 1.239 . . . . 0.0 110.015 170.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 54.2 m -91.87 94.34 9.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.679 1.192 . . . . 0.0 110.551 171.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -79.81 125.91 30.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.243 0.617 . . . . 0.0 111.175 175.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 85.0 mt -99.8 114.48 38.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 C-N-CA 125.367 1.467 . . . . 0.0 108.057 172.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -84.91 87.36 7.34 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.735 -0.603 . . . . 0.0 110.109 167.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 t -152.17 171.23 18.25 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.201 1.0 . . . . 0.0 113.138 170.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -77.07 163.85 62.6 Favored Pre-proline 0 N--CA 1.474 0.727 0 C-N-CA 126.975 2.11 . . . . 0.0 110.852 173.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.58 -23.2 23.48 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 122.347 2.031 . . . . 0.0 114.408 176.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -60.15 -57.93 23.06 Favored Pre-proline 0 N--CA 1.474 0.756 0 C-N-CA 124.605 1.162 . . . . 0.0 113.211 -177.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -70.0 -0.81 7.66 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.164 2.576 . . . . 0.0 114.813 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -100.26 -55.19 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.327 1.851 . . . . 0.0 109.549 176.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -44.2 82.39 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.224 -0.922 . . . . 0.0 112.97 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.21 -4.38 38.56 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -172.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 61.7 mt -53.17 -36.01 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 123.713 0.805 . . . . 0.0 110.672 170.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 32.0 p -110.22 159.1 17.69 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.528 1.131 . . . . 0.0 113.056 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -156.35 103.77 2.18 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.623 1.569 . . . . 0.0 110.688 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.65 3.7 85.97 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.288 0.947 . . . . 0.0 114.912 -178.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.3 mt -74.32 115.22 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 118.544 1.172 . . . . 0.0 111.161 -178.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.9 mt -108.43 -14.11 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 126.442 1.897 . . . . 0.0 110.867 171.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.42 5.76 2.76 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 127.732 2.413 . . . . 0.0 116.396 -169.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.2 t 51.42 65.87 1.36 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.498 1.519 . . . . 0.0 112.862 -171.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -154.89 157.06 37.23 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 126.206 1.803 . . . . 0.0 111.106 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.534 HD22 HG23 ' A' ' 16' ' ' VAL . 6.2 t-20 -142.29 -170.15 3.11 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.859 -1.151 . . . . 0.0 111.778 163.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.15 142.4 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.833 1.653 . . . . 0.0 108.625 171.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.0 tp -49.67 140.86 10.61 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.587 1.155 . . . . 0.0 111.945 169.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.49 172.66 1.48 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -118.06 -30.54 5.3 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.89 1.276 . . . . 0.0 113.474 179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.2 m -76.91 171.5 14.66 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.801 1.64 . . . . 0.0 112.457 177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -118.84 102.34 8.73 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.434 1.094 . . . . 0.0 111.667 -176.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -95.53 161.62 13.98 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.007 1.723 . . . . 0.0 111.135 -176.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.7 m-85 -75.22 100.83 4.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.327 0.651 . . . . 0.0 110.537 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.24 128.99 37.28 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.203 . . . . 0.0 112.049 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 44.4 t -130.59 90.08 2.87 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 125.654 1.581 . . . . 0.0 110.074 -175.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -88.6 160.2 17.53 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 121.865 0.84 . . . . 0.0 111.419 171.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.3 m -147.35 142.79 27.47 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 125.586 1.554 . . . . 0.0 107.951 164.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -132.76 128.91 37.85 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.616 1.167 . . . . 0.0 109.755 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.6 t -57.77 147.22 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 123.962 0.905 . . . . 0.0 111.703 -176.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.65 103.61 5.28 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.158 0.983 . . . . 0.0 112.31 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 42.7 m . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.563 1.945 . . . . 0.0 113.473 179.748 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 119.129 -0.462 . . . . 0.0 111.898 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.01 -48.86 0.21 Allowed 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.594 1.529 . . . . 0.0 112.538 -177.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.89 175.81 10.15 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 127.022 2.129 . . . . 0.0 110.119 -177.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -106.82 128.65 54.44 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.877 1.271 . . . . 0.0 110.672 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -135.22 158.19 45.01 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.78 1.232 . . . . 0.0 112.669 -177.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.0 mtpp -89.02 155.9 19.2 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.618 2.367 . . . . 0.0 111.407 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -93.29 105.13 17.25 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.573 1.549 . . . . 0.0 110.513 -176.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -132.3 101.9 5.55 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.131 1.373 . . . . 0.0 112.278 -176.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -114.08 137.51 51.63 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.608 1.563 . . . . 0.0 110.971 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.2 m -142.33 169.13 18.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.868 1.667 . . . . 0.0 111.047 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.8 m -143.54 103.79 4.14 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 121.077 -1.015 . . . . 0.0 111.387 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.83 172.16 6.85 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.799 1.24 . . . . 0.0 113.535 -170.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.81 170.28 0.43 Allowed 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 128.974 2.909 . . . . 0.0 114.327 165.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.58 150.47 36.45 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.884 2.074 . . . . 0.0 111.395 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 2.1 t -112.29 146.25 38.55 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.845 0.831 . . . . 0.0 112.434 176.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.2 m -149.19 -177.31 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 126.596 1.958 . . . . 0.0 111.697 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.6 m -128.11 116.26 19.68 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 125.029 1.332 . . . . 0.0 111.908 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.5 t -83.91 130.24 34.91 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.101 0.96 . . . . 0.0 111.433 176.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -137.09 115.04 11.45 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 124.954 1.302 . . . . 0.0 108.969 174.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 57.53 57.31 4.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.869 1.268 . . . . 0.0 112.498 -172.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 64.4 26.1 13.48 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.254 2.222 . . . . 0.0 114.734 170.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.21 134.43 5.77 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.227 1.411 . . . . 0.0 109.528 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.498 2.799 . . . . 0.0 113.317 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.8 m -106.62 16.84 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 126.498 1.919 . . . . 0.0 112.566 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -153.14 142.97 22.08 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.631 -1.293 . . . . 0.0 111.322 176.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -84.38 154.52 22.8 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.986 0.514 . . . . 0.0 110.419 168.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.3 t -124.28 -55.49 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.571 0.749 . . . . 0.0 112.339 167.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.09 -172.34 43.25 Favored Glycine 0 CA--C 1.53 1.028 0 CA-C-N 119.028 0.831 . . . . 0.0 115.104 -170.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 46.7 t -127.13 123.03 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.823 1.649 . . . . 0.0 110.672 -169.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.24 1.04 8.72 Favored Glycine 0 CA--C 1.541 1.66 0 C-N-CA 124.973 1.273 . . . . 0.0 115.97 178.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.7 m -166.09 166.6 17.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 129.912 3.285 . . . . 0.0 108.964 -174.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.5 t -124.43 111.79 16.16 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.424 1.09 . . . . 0.0 111.181 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -96.82 147.17 18.59 Favored Glycine 0 CA--C 1.535 1.305 0 C-N-CA 124.506 1.05 . . . . 0.0 113.402 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.5 t -152.87 168.69 24.92 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.111 1.365 . . . . 0.0 111.851 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 165.18 170.54 30.27 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 125.612 1.577 . . . . 0.0 113.514 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -99.86 82.03 0.53 Allowed Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.407 1.479 . . . . 0.0 112.548 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.8 t -140.89 170.14 16.31 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.92 1.288 . . . . 0.0 112.557 177.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -94.47 12.99 68.12 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 126.614 2.054 . . . . 0.0 115.549 -173.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 50.8 mt -59.67 135.72 23.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 125.936 1.694 . . . . 0.0 111.356 -174.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -144.64 19.6 1.67 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.811 1.645 . . . . 0.0 113.209 179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 67.6 mt -67.23 -24.62 65.84 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.508 -1.37 . . . . 0.0 113.988 -174.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -72.78 170.08 15.38 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 126.256 1.822 . . . . 0.0 113.799 173.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.3 m -62.14 -33.78 75.12 Favored 'General case' 0 N--CA 1.485 1.29 0 O-C-N 121.007 -1.058 . . . . 0.0 112.312 174.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.7 t 48.5 72.04 0.31 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 127.71 2.404 . . . . 0.0 113.846 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.3 mp -68.59 0.22 4.38 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 126.409 1.883 . . . . 0.0 115.582 -175.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.6 p -62.11 -36.11 80.76 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.681 1.592 . . . . 0.0 114.214 -179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -129.06 113.77 15.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.534 1.534 . . . . 0.0 111.038 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.03 0.35 60.1 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 125.007 1.289 . . . . 0.0 115.108 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.4 m -137.52 -172.15 3.15 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.391 1.476 . . . . 0.0 111.428 175.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -154.37 172.14 18.17 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.879 1.672 . . . . 0.0 110.611 -175.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -56.96 -35.94 69.72 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.748 2.019 . . . . 0.0 112.297 171.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -32.01 70.1 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.971 1.309 . . . . 0.0 112.448 178.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.8 p -92.22 -28.72 16.85 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.734 1.613 . . . . 0.0 113.859 172.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -52.73 -45.48 67.0 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.429 1.492 . . . . 0.0 112.55 176.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -55.61 -60.68 3.09 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.417 1.087 . . . . 0.0 110.812 175.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 34.1 mttp -58.01 -25.26 60.87 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -177.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.2 mmtp -68.49 -54.38 17.23 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.058 1.343 . . . . 0.0 113.687 179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -141.7 14.91 2.14 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 115.81 1.782 . . . . 0.0 115.81 -169.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.0 mt -126.33 146.09 32.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 O-C-N 120.771 -1.205 . . . . 0.0 110.066 175.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -142.56 151.92 42.07 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.392 0.677 . . . . 0.0 112.352 170.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -87.73 0.32 55.89 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.207 1.403 . . . . 0.0 112.206 170.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 t -159.44 107.17 1.76 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.421 1.888 . . . . 0.0 110.593 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.5 ttp-105 -64.35 105.41 0.92 Allowed 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.734 -1.229 . . . . 0.0 110.973 175.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -112.25 1.77 16.3 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.347 1.459 . . . . 0.0 113.431 177.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.6 p -75.22 145.52 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 125.087 1.355 . . . . 0.0 112.572 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -132.34 8.42 4.3 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.172 1.789 . . . . 0.0 112.782 172.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 52.1 m 51.45 37.38 19.14 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.786 2.434 . . . . 0.0 114.011 -175.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -148.28 -22.05 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.421 2.689 . . . . 0.0 112.896 176.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 57.7 m-80 -106.65 -3.37 20.72 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.564 1.546 . . . . 0.0 113.398 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.2 pt -64.37 -8.94 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 125.041 1.336 . . . . 0.0 113.571 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.6 ttt -56.67 -23.28 40.66 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.153 1.381 . . . . 0.0 113.123 164.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.8 t -99.86 -3.25 32.93 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.24 1.816 . . . . 0.0 114.076 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.6 p -107.42 -176.79 3.17 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.064 1.345 . . . . 0.0 111.373 176.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -64.37 -17.11 63.43 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 120.952 -1.092 . . . . 0.0 113.463 176.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -92.06 17.96 8.68 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.573 1.949 . . . . 0.0 113.849 -173.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -66.61 -8.01 24.29 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.707 2.003 . . . . 0.0 114.27 -178.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -60.77 -2.47 0.55 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 128.252 2.621 . . . . 0.0 115.958 -175.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.9 t 49.09 53.73 12.11 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.182 1.793 . . . . 0.0 113.058 -174.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 167.38 2.72 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.598 1.159 . . . . 0.0 112.303 170.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -76.49 -29.26 56.78 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.839 1.255 . . . . 0.0 112.764 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.4 ptmm? -170.33 161.43 8.13 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.485 2.314 . . . . 0.0 110.642 176.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -147.08 143.45 28.33 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.599 0.76 . . . . 0.0 110.819 164.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 56.2 m -90.88 115.07 27.64 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.063 1.345 . . . . 0.0 109.197 170.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -96.94 128.34 43.8 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.481 1.037 . . . . 0.0 111.042 165.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 69.5 mt -99.97 112.87 33.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.662 1.585 . . . . 0.0 107.062 174.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -86.82 92.18 8.89 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.538 -0.726 . . . . 0.0 109.636 170.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 83.6 p -146.84 177.18 9.32 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.633 1.573 . . . . 0.0 112.728 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.31 160.04 46.27 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 125.385 1.474 . . . . 0.0 110.503 164.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -72.66 -22.08 21.15 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 122.584 2.189 . . . . 0.0 114.305 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -60.37 -55.78 41.85 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 124.902 1.281 . . . . 0.0 112.369 -178.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.56 -0.93 7.45 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.371 2.714 . . . . 0.0 115.187 176.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.7 t -99.73 -53.89 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.718 1.607 . . . . 0.0 110.003 175.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -43.93 81.94 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 121.258 -0.902 . . . . 0.0 112.747 -179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -76.5 -3.49 37.61 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -172.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 56.6 mt -53.73 -35.78 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.627 0.771 . . . . 0.0 110.332 170.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 22.5 p -111.26 157.51 20.05 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.856 1.263 . . . . 0.0 113.304 172.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -154.5 110.62 3.23 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.571 1.948 . . . . 0.0 109.756 175.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.43 3.47 88.53 Favored Glycine 0 CA--C 1.537 1.442 0 C-N-CA 124.645 1.117 . . . . 0.0 114.873 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.4 mt -77.47 116.82 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.681 1.192 . . . . 0.0 111.067 -177.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.8 mt -111.61 -11.4 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.786 2.034 . . . . 0.0 110.769 173.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.2 5.89 4.03 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.617 2.367 . . . . 0.0 116.118 -170.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 18.3 t 52.71 64.93 1.67 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.568 1.547 . . . . 0.0 112.975 -173.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -157.33 152.57 26.11 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 126.053 1.741 . . . . 0.0 110.721 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -138.71 -172.03 3.21 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.909 -1.119 . . . . 0.0 111.645 164.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.8 t -124.37 141.22 45.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 125.59 1.556 . . . . 0.0 108.51 173.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.7 tp -49.63 140.93 10.37 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.505 1.122 . . . . 0.0 111.784 170.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -61.68 174.11 0.86 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 174.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 12.5 t -122.39 -20.92 5.95 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.114 1.366 . . . . 0.0 113.762 179.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.4 m -85.66 171.73 11.42 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.737 1.615 . . . . 0.0 111.902 176.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.32 109.53 16.94 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.446 1.099 . . . . 0.0 111.41 -178.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -105.12 160.19 15.26 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.926 1.69 . . . . 0.0 110.293 -175.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -71.67 108.79 5.19 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.708 -0.62 . . . . 0.0 110.711 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -95.66 121.96 37.92 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.573 1.149 . . . . 0.0 111.574 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.4 t -121.92 88.66 2.98 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.269 1.828 . . . . 0.0 109.523 -175.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -88.14 158.62 18.49 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 121.384 -0.823 . . . . 0.0 111.166 173.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.2 m -145.74 141.23 27.81 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.041 0.936 . . . . 0.0 108.538 162.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -133.27 128.3 35.52 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.211 1.405 . . . . 0.0 110.008 -173.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.8 t -59.5 145.77 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 CA-C-N 118.87 0.759 . . . . 0.0 112.54 -175.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.6 t -133.02 100.19 4.81 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.777 1.631 . . . . 0.0 111.011 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.4 t . . . . . 0 C--O 1.253 1.284 0 C-N-CA 126.564 1.945 . . . . 0.0 111.519 -178.252 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 118.702 -0.666 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -72.63 -58.73 0.07 OUTLIER 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.361 2.041 . . . . 0.0 111.862 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 81.8 m -139.67 171.82 13.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.597 2.359 . . . . 0.0 109.813 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -91.51 137.19 32.56 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.716 1.207 . . . . 0.0 110.451 175.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -137.44 165.05 27.19 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.201 1.401 . . . . 0.0 111.94 177.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 40.1 mtpt -98.84 159.02 15.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 127.247 2.219 . . . . 0.0 112.08 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -91.64 110.43 21.75 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.276 1.83 . . . . 0.0 111.583 176.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -135.8 115.66 13.09 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 126.203 1.801 . . . . 0.0 111.322 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp -122.16 150.34 42.37 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.376 1.07 . . . . 0.0 111.548 176.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 4.8 t -150.48 170.65 18.59 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.987 1.315 . . . . 0.0 111.788 173.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.1 m -140.81 104.33 4.68 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.866 0.866 . . . . 0.0 110.963 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.6 172.99 7.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 125.146 1.378 . . . . 0.0 112.767 -172.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.85 172.21 1.39 Allowed 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.41 1.884 . . . . 0.0 113.941 168.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.6 p90 -139.22 155.63 47.66 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 126.42 1.888 . . . . 0.0 110.161 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.5 t -113.91 146.24 40.34 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.078 1.351 . . . . 0.0 111.769 174.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.6 m -148.95 -178.45 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 126.415 1.886 . . . . 0.0 111.744 -175.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.8 m -125.51 117.73 24.24 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.96 1.304 . . . . 0.0 111.715 175.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.74 130.99 34.95 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 124.083 0.953 . . . . 0.0 111.503 176.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -138.51 112.66 8.61 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.127 1.371 . . . . 0.0 108.978 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 57.92 57.81 3.94 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.914 1.286 . . . . 0.0 112.451 -172.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 63.97 26.95 14.26 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 127.407 2.283 . . . . 0.0 114.776 170.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -160.08 134.89 5.53 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.231 1.413 . . . . 0.0 109.744 -176.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -75.85 109.1 2.83 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 123.667 2.911 . . . . 0.0 113.38 178.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.7 m -109.27 17.56 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 126.611 1.965 . . . . 0.0 112.722 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 -152.68 139.18 18.63 Favored 'General case' 0 N--CA 1.477 0.895 0 O-C-N 120.576 -1.328 . . . . 0.0 110.656 175.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -84.49 147.88 26.83 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.954 0.502 . . . . 0.0 110.879 170.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.4 t -121.28 -54.49 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.404 0.682 . . . . 0.0 112.573 175.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.87 -173.66 43.51 Favored Glycine 0 CA--C 1.528 0.865 0 CA-C-N 119.247 0.931 . . . . 0.0 115.149 -171.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 35.3 t -129.19 118.48 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 125.892 1.677 . . . . 0.0 110.181 -172.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.43 4.76 25.76 Favored Glycine 0 CA--C 1.542 1.75 0 N-CA-C 115.663 1.025 . . . . 0.0 115.663 -174.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.2 p -165.82 166.0 17.98 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 127.625 2.37 . . . . 0.0 111.123 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.0 m -110.34 110.64 21.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.341 1.457 . . . . 0.0 110.526 172.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.92 160.99 53.76 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 123.459 0.552 . . . . 0.0 112.849 172.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.1 t -151.48 177.38 10.37 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.536 1.535 . . . . 0.0 111.647 177.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -170.64 175.06 44.57 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 125.296 1.426 . . . . 0.0 113.727 178.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -131.6 18.38 4.89 Favored Glycine 0 CA--C 1.535 1.33 0 C-N-CA 125.651 1.596 . . . . 0.0 115.051 -175.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 62.3 m -123.88 156.84 35.52 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.842 1.657 . . . . 0.0 112.269 -175.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -81.67 49.13 4.0 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 125.53 1.538 . . . . 0.0 114.741 -173.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 49.8 mm -72.07 143.67 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.298 1.439 . . . . 0.0 111.295 -178.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -140.36 6.14 2.1 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.642 1.577 . . . . 0.0 114.278 -176.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -67.69 -22.43 65.28 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.063 1.345 . . . . 0.0 113.082 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -65.12 163.27 15.29 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.038 1.335 . . . . 0.0 112.983 169.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.4 m -66.33 -32.52 73.97 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 121.053 -1.029 . . . . 0.0 112.773 174.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.2 t 40.35 71.83 0.17 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 127.655 2.382 . . . . 0.0 113.965 -170.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.6 mp -59.57 -13.76 10.56 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 178.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 31.0 t -56.98 -31.87 65.5 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.992 1.717 . . . . 0.0 113.415 167.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -122.6 105.86 10.48 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.263 1.425 . . . . 0.0 111.406 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.62 2.91 64.9 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.926 1.251 . . . . 0.0 115.394 -179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -137.09 -168.99 2.39 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.472 1.509 . . . . 0.0 110.893 173.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.6 p30 -155.78 176.45 12.61 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.989 2.115 . . . . 0.0 110.627 -178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.6 t-105 -59.74 -35.17 74.02 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.376 1.47 . . . . 0.0 112.943 173.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -48.11 83.04 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.501 1.12 . . . . 0.0 110.977 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.8 p -74.53 -31.18 62.05 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.42 1.488 . . . . 0.0 113.481 174.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.3 t80 -54.79 -41.14 70.21 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.055 1.342 . . . . 0.0 113.068 175.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -60.43 -61.71 2.4 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.514 0.725 . . . . 0.0 110.484 173.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -59.12 -21.35 59.15 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.1 tpmt? -65.13 -56.53 12.41 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.235 1.814 . . . . 0.0 113.017 173.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -147.45 22.81 1.16 Allowed 'General case' 0 N--CA 1.484 1.248 0 N-CA-C 115.529 1.678 . . . . 0.0 115.529 -172.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -126.6 147.73 31.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.368 1.467 . . . . 0.0 109.291 178.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 t -143.36 152.75 41.98 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -84.24 -1.52 55.35 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.869 1.668 . . . . 0.0 112.804 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.2 t -162.32 109.73 1.33 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.337 1.855 . . . . 0.0 110.971 176.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 63.4 ttp85 -67.17 106.5 2.02 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 120.459 -1.401 . . . . 0.0 110.556 172.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -116.35 3.05 13.3 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.129 1.372 . . . . 0.0 113.036 176.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.411 HG22 ' H ' ' A' ' 67' ' ' CYS . 13.8 p -74.64 147.26 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 124.775 1.23 . . . . 0.0 113.168 -174.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -132.03 2.13 3.95 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.2 1.8 . . . . 0.0 113.266 174.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.411 ' H ' HG22 ' A' ' 65' ' ' VAL . 93.8 m 45.66 54.31 7.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.447 2.299 . . . . 0.0 113.346 -174.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -152.89 -29.88 0.14 Allowed 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 128.372 2.669 . . . . 0.0 111.751 178.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -108.94 -4.06 17.04 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.77 1.628 . . . . 0.0 114.136 -179.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.9 pt -61.98 -7.74 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -178.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 9.9 tpt -52.46 -27.8 17.59 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.277 1.431 . . . . 0.0 113.823 169.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 99.9 p -90.45 -5.14 56.44 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 175.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 p -100.43 -179.39 4.09 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.715 1.606 . . . . 0.0 111.695 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -68.92 -15.51 63.51 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.93 5.77 18.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.319 1.848 . . . . 0.0 114.849 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -63.14 -8.19 7.34 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 127.939 2.496 . . . . 0.0 115.207 -174.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -62.07 -5.68 2.4 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.446 1.898 . . . . 0.0 114.719 -173.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 43.5 t 47.18 45.88 16.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.923 1.689 . . . . 0.0 112.69 -170.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 157.33 21.82 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.876 1.27 . . . . 0.0 111.656 167.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -63.87 -34.22 77.45 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.659 1.184 . . . . 0.0 113.993 -171.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 9.7 ptmm? -163.04 158.9 22.66 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.069 1.748 . . . . 0.0 111.77 174.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -134.02 122.33 22.86 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 124.638 1.175 . . . . 0.0 110.105 173.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -88.16 92.73 9.26 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.149 0.579 . . . . 0.0 110.047 175.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -78.66 126.05 30.2 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.884 -0.51 . . . . 0.0 111.253 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -99.12 115.57 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.833 1.253 . . . . 0.0 108.091 171.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -88.68 87.37 7.23 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.904 -0.497 . . . . 0.0 110.005 167.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.8 t -151.39 171.07 18.07 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.267 1.027 . . . . 0.0 112.998 171.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.6 mtp-105 -74.64 163.62 67.01 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 126.376 1.871 . . . . 0.0 110.934 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.84 -24.08 25.13 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.24 1.96 . . . . 0.0 114.393 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -61.54 -57.12 27.08 Favored Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 124.92 1.288 . . . . 0.0 112.95 -175.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.37 -1.06 8.36 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 123.194 2.596 . . . . 0.0 114.602 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -99.72 -54.62 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 126.291 1.836 . . . . 0.0 109.665 175.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -44.96 77.61 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.41 -0.806 . . . . 0.0 112.843 -178.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.76 -4.11 38.64 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -172.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 58.4 mt -53.72 -35.56 27.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 123.702 0.801 . . . . 0.0 110.654 170.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.0 p -110.69 157.84 19.29 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.842 1.257 . . . . 0.0 113.196 172.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -155.45 109.26 2.83 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.985 1.714 . . . . 0.0 110.373 177.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.05 2.41 88.25 Favored Glycine 0 CA--C 1.537 1.428 0 C-N-CA 124.57 1.081 . . . . 0.0 114.909 -178.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.9 mt -76.23 118.92 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 124.752 1.221 . . . . 0.0 111.223 -177.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -113.27 -9.7 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.047 0 C-N-CA 126.887 2.075 . . . . 0.0 110.863 173.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -75.4 7.72 3.34 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 127.517 2.327 . . . . 0.0 116.01 -170.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 79.4 p 50.24 61.8 3.01 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 125.711 1.605 . . . . 0.0 113.909 -173.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -156.14 155.99 33.47 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 125.576 1.551 . . . . 0.0 110.952 176.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -138.65 -171.81 3.15 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.959 -1.088 . . . . 0.0 111.106 166.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.4 t -124.87 142.34 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.294 1.437 . . . . 0.0 108.583 173.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 35.1 tp -47.97 137.4 10.19 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.241 1.016 . . . . 0.0 111.99 170.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.88 171.95 1.93 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.618 0.767 . . . . 0.0 112.293 175.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 10.6 t -118.27 -25.61 6.54 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.401 1.081 . . . . 0.0 113.835 -178.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.1 m -82.4 169.81 16.01 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.655 1.182 . . . . 0.0 111.989 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -116.76 103.56 10.47 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.281 1.032 . . . . 0.0 111.4 -175.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.6 m-85 -98.33 162.12 13.34 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 125.75 1.62 . . . . 0.0 110.96 -175.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -72.64 105.81 4.41 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.918 -0.489 . . . . 0.0 110.122 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -97.93 124.62 42.45 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.615 1.166 . . . . 0.0 111.642 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.1 t -125.62 95.08 4.32 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 125.647 1.579 . . . . 0.0 110.05 -172.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.97 138.65 31.85 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.961 1.304 . . . . 0.0 110.506 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 43.3 m -113.32 151.4 31.24 Favored 'General case' 0 N--CA 1.468 0.463 0 O-C-N 120.95 -1.094 . . . . 0.0 108.481 161.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -135.57 123.65 22.91 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.811 0.844 . . . . 0.0 109.391 178.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.1 t -57.05 146.23 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.648 0.779 . . . . 0.0 111.483 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -135.65 103.63 5.5 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.235 1.014 . . . . 0.0 111.666 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.253 1.285 0 C-N-CA 126.693 1.997 . . . . 0.0 111.426 179.671 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -72.2 -48.52 0.35 Allowed 'Trans proline' 0 C--N 1.356 0.949 0 C-N-CA 122.105 1.87 . . . . 0.0 113.305 -165.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 98.4 m -136.92 -167.89 2.17 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 127.692 2.397 . . . . 0.0 109.352 175.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.12 146.97 43.76 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.565 1.146 . . . . 0.0 109.327 168.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -141.51 161.31 38.22 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.456 1.502 . . . . 0.0 110.423 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -105.42 158.04 16.93 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.031 1.332 . . . . 0.0 113.766 177.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.72 110.9 18.17 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.701 2.0 . . . . 0.0 111.466 -171.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -134.98 98.43 4.01 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.086 1.354 . . . . 0.0 112.234 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -116.5 137.27 52.3 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.398 1.479 . . . . 0.0 111.171 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 72.9 m -145.94 167.44 23.28 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.141 1.776 . . . . 0.0 111.027 -175.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.1 m -140.3 104.53 4.81 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.289 -0.882 . . . . 0.0 111.24 177.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.86 171.82 5.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.937 1.295 . . . . 0.0 113.252 -170.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.458 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -62.98 172.73 1.62 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 128.788 2.835 . . . . 0.0 113.658 168.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -143.46 145.33 32.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.569 1.948 . . . . 0.0 111.643 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.3 t -105.36 139.33 40.16 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.023 0.929 . . . . 0.0 111.277 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.523 HG23 HD22 ' A' ' 104' ' ' ASN . 15.9 m -146.88 -178.93 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.054 0 C-N-CA 126.306 1.842 . . . . 0.0 111.335 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.2 m -127.03 116.02 20.09 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.688 1.195 . . . . 0.0 111.552 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -85.45 131.57 34.36 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.345 0.658 . . . . 0.0 111.616 173.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.84 115.45 10.62 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.22 1.408 . . . . 0.0 108.55 176.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 58.6 54.98 5.05 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.958 1.303 . . . . 0.0 112.335 -170.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 65.03 25.54 12.63 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.493 2.317 . . . . 0.0 115.077 169.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.6 133.08 5.73 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.962 1.305 . . . . 0.0 109.653 -175.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -75.91 108.55 2.71 Favored 'Trans proline' 0 CA--C 1.536 0.598 0 C-N-CA 123.803 3.002 . . . . 0.0 112.984 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.483 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.8 m -111.01 15.84 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 126.169 1.788 . . . . 0.0 113.044 -178.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.4 143.67 24.07 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.139 1.336 . . . . 0.0 111.086 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -102.39 126.78 49.52 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.677 1.191 . . . . 0.0 111.407 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.6 t -101.68 -56.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.903 0.881 . . . . 0.0 111.852 -178.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.27 -171.78 41.15 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 114.985 0.754 . . . . 0.0 114.985 -170.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.1 t -131.26 120.39 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 126.005 1.722 . . . . 0.0 110.168 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.27 2.29 25.34 Favored Glycine 0 CA--C 1.542 1.752 0 N-CA-C 115.579 0.992 . . . . 0.0 115.579 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 97.4 p -170.28 166.86 8.68 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 127.895 2.478 . . . . 0.0 111.079 -176.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.8 m -107.47 110.56 22.53 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.539 1.536 . . . . 0.0 110.996 173.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -89.11 78.2 1.69 Allowed Glycine 0 CA--C 1.534 1.223 0 C-N-CA 125.332 1.444 . . . . 0.0 113.245 -177.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 6.6 t -82.21 174.58 11.05 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.617 1.167 . . . . 0.0 113.197 177.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 177.76 -179.27 48.37 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 126.303 1.906 . . . . 0.0 113.38 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -134.13 60.03 0.66 Allowed Glycine 0 CA--C 1.533 1.185 0 C-N-CA 125.544 1.545 . . . . 0.0 113.378 -175.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.8 m -137.19 161.45 36.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.694 1.597 . . . . 0.0 112.107 -178.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -80.38 25.69 3.2 Favored Glycine 0 CA--C 1.539 1.531 0 C-N-CA 125.916 1.722 . . . . 0.0 115.684 -175.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 68.4 mt -65.5 139.51 21.2 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 125.83 1.652 . . . . 0.0 110.815 -175.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -150.81 8.95 0.58 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.156 1.383 . . . . 0.0 113.629 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 pp -62.71 -27.96 69.62 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.378 1.471 . . . . 0.0 114.747 -178.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -59.6 162.81 4.72 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.884 2.074 . . . . 0.0 113.481 171.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.1 m -58.8 -31.04 68.07 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 121.079 -1.013 . . . . 0.0 112.799 178.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.4 t 47.82 59.36 4.24 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 126.93 2.092 . . . . 0.0 113.303 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.7 mp -59.78 -14.18 13.54 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -173.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.8 p -62.14 -28.47 69.67 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.568 1.547 . . . . 0.0 114.143 171.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.55 104.61 8.81 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.535 1.534 . . . . 0.0 111.627 175.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 103.19 -2.5 47.28 Favored Glycine 0 CA--C 1.536 1.361 0 C-N-CA 125.449 1.5 . . . . 0.0 115.255 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.1 m -136.4 -166.07 1.83 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.016 1.326 . . . . 0.0 111.435 175.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -153.22 170.61 20.14 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.752 2.021 . . . . 0.0 109.279 -178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.483 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.0 t-105 -54.19 -36.97 63.99 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.585 1.554 . . . . 0.0 112.293 166.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -44.41 92.02 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.901 0.881 . . . . 0.0 111.491 -179.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 19.6 p -84.97 -26.05 27.39 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.297 1.039 . . . . 0.0 113.771 176.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -52.47 -42.3 64.09 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.785 1.634 . . . . 0.0 112.996 173.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -57.62 -62.54 1.72 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.056 0.942 . . . . 0.0 110.475 172.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.22 -22.13 50.73 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -178.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -67.65 -55.23 14.09 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 126.186 1.795 . . . . 0.0 112.44 175.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.4 p80 -146.52 22.27 1.31 Allowed 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.676 1.732 . . . . 0.0 115.676 -173.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -126.78 147.84 31.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 O-C-N 120.473 -1.392 . . . . 0.0 109.006 177.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.8 t -143.05 152.08 41.49 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 176.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.1 p30 -83.27 -1.5 53.32 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.838 1.655 . . . . 0.0 112.779 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 9.9 t -163.26 107.48 1.05 Allowed 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 126.204 1.802 . . . . 0.0 111.429 177.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.8 ttp180 -67.92 110.54 3.91 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.376 -1.453 . . . . 0.0 110.42 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -129.33 7.71 5.42 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.603 1.561 . . . . 0.0 113.088 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 55.5 t -75.68 141.35 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.804 1.241 . . . . 0.0 111.983 -172.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -126.3 4.99 7.01 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 126.075 1.75 . . . . 0.0 113.437 -178.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.0 m 55.07 40.12 31.8 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 126.957 2.103 . . . . 0.0 114.26 177.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -152.16 -26.23 0.18 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 127.084 2.154 . . . . 0.0 113.432 179.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -99.61 -5.24 29.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.63 1.172 . . . . 0.0 113.482 176.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -64.53 -5.07 1.94 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.939 1.296 . . . . 0.0 114.435 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -53.5 -25.93 18.66 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 160.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 7.3 t -97.54 -15.84 20.35 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.708 1.603 . . . . 0.0 113.844 -178.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 49.3 p -94.75 -179.81 4.99 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.014 1.326 . . . . 0.0 110.94 175.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -68.43 -11.19 59.35 Favored 'General case' 0 CA--C 1.55 0.947 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 178.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -85.52 12.54 8.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 127.548 2.339 . . . . 0.0 114.811 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 36.5 p90 -67.21 -8.77 34.06 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 127.061 2.144 . . . . 0.0 114.76 -171.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -62.59 -6.64 3.67 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.445 2.298 . . . . 0.0 115.384 -174.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.0 t 40.55 56.02 2.81 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.513 1.925 . . . . 0.0 112.949 -165.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 158.87 28.17 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.223 1.409 . . . . 0.0 111.61 167.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -65.82 -35.48 80.8 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -172.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 5.3 ptmm? -160.4 156.53 26.27 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.097 1.759 . . . . 0.0 111.564 170.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -131.34 129.45 41.42 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.775 1.23 . . . . 0.0 109.61 170.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.0 m -96.83 93.84 6.9 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.691 0.796 . . . . 0.0 109.68 177.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -77.89 127.86 33.04 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.529 0.732 . . . . 0.0 111.394 175.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.6 mt -105.77 114.2 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 125.985 1.714 . . . . 0.0 107.901 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -86.35 84.2 7.51 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.822 -0.549 . . . . 0.0 110.479 170.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.8 m -141.88 158.29 43.97 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.611 1.565 . . . . 0.0 112.665 178.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -72.41 161.48 78.86 Favored Pre-proline 0 N--CA 1.474 0.737 0 C-N-CA 124.898 1.279 . . . . 0.0 110.762 164.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -70.8 -21.58 28.47 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 122.401 2.067 . . . . 0.0 114.375 177.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -61.5 -58.11 20.7 Favored Pre-proline 0 CA--C 1.544 0.719 0 CA-C-N 119.551 1.069 . . . . 0.0 112.572 -178.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -69.37 0.41 5.39 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.148 2.565 . . . . 0.0 115.039 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -103.61 -54.96 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 126.336 1.854 . . . . 0.0 109.747 177.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -44.47 78.88 Favored 'General case' 0 N--CA 1.473 0.689 0 O-C-N 121.112 -0.993 . . . . 0.0 112.884 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.11 32.98 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 114.509 1.299 . . . . 0.0 114.509 -173.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.2 mt -52.61 -35.95 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.622 0.769 . . . . 0.0 110.645 169.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.8 p -109.8 159.99 16.72 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.286 1.034 . . . . 0.0 113.277 174.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 tptp -155.11 107.2 2.68 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 125.694 1.598 . . . . 0.0 110.567 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 6.29 88.67 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.275 0.941 . . . . 0.0 114.898 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.1 mt -76.56 115.39 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 CA-C-N 118.518 1.159 . . . . 0.0 110.952 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 mt -112.33 -10.59 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 126.833 2.053 . . . . 0.0 110.893 173.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.96 3.79 6.32 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 127.406 2.282 . . . . 0.0 115.72 -173.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.1 t 53.44 66.2 1.3 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.819 1.647 . . . . 0.0 113.013 -173.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 13.5 tptm -156.46 160.53 39.65 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.281 1.832 . . . . 0.0 111.298 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.523 HD22 HG23 ' A' ' 16' ' ' VAL . 5.7 t-20 -142.31 -169.73 3.02 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.693 -1.254 . . . . 0.0 111.733 164.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 25.5 t -125.08 139.68 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 125.652 1.581 . . . . 0.0 108.783 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 30.9 tp -49.53 139.71 11.83 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.743 1.217 . . . . 0.0 111.836 170.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.1 172.28 1.47 Allowed 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 174.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.1 t -122.49 -30.36 3.94 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.93 1.292 . . . . 0.0 113.802 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 69.5 m -75.63 169.89 17.23 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.546 1.138 . . . . 0.0 111.648 171.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -123.7 105.03 9.36 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.991 0.916 . . . . 0.0 111.524 -173.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -100.28 163.76 12.25 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 126.622 1.969 . . . . 0.0 110.835 -171.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -73.86 104.16 4.64 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.724 -0.61 . . . . 0.0 110.411 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -97.07 131.0 44.29 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.089 1.355 . . . . 0.0 111.892 179.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 46.6 t -135.84 96.8 3.49 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.156 1.382 . . . . 0.0 110.801 -172.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -93.6 155.03 17.52 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.706 0.765 . . . . 0.0 111.77 171.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.08 99.24 3.42 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.594 0.757 . . . . 0.0 110.979 171.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -86.59 133.05 33.75 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.74 1.216 . . . . 0.0 111.2 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.1 t -56.98 147.79 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 C-N-CA 125.075 1.35 . . . . 0.0 111.933 177.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 76.5 p -120.89 96.21 5.02 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.065 1.346 . . . . 0.0 111.536 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.8 t . . . . . 0 C--O 1.252 1.231 0 C-N-CA 125.456 1.502 . . . . 0.0 112.762 176.479 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 61.8 mtt85 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 118.964 -0.541 . . . . 0.0 109.95 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -72.66 -52.05 0.17 Allowed 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 121.863 1.708 . . . . 0.0 112.881 -169.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 71.0 m -141.63 168.33 20.01 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.157 2.183 . . . . 0.0 110.064 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -87.97 137.55 32.23 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.767 1.227 . . . . 0.0 109.997 172.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -137.17 160.86 37.77 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.694 1.198 . . . . 0.0 112.29 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -96.15 155.31 16.81 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 127.635 2.374 . . . . 0.0 111.447 178.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tp -80.34 127.89 32.92 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.674 1.19 . . . . 0.0 111.352 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -147.33 96.86 2.77 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.335 1.454 . . . . 0.0 112.006 171.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.1 mmtm -100.55 149.12 24.05 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.193 1.397 . . . . 0.0 111.208 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 29.6 m -155.89 169.0 25.44 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.203 1.801 . . . . 0.0 111.152 175.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.6 m -141.17 105.27 4.79 Favored 'General case' 0 N--CA 1.477 0.885 0 O-C-N 121.293 -0.88 . . . . 0.0 110.867 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.28 172.09 6.39 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.778 1.231 . . . . 0.0 113.652 -171.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.78 174.24 0.63 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 128.241 2.616 . . . . 0.0 114.515 168.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.79 143.77 31.5 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 126.878 2.071 . . . . 0.0 111.702 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 30.9 t -102.99 140.23 37.52 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.569 1.148 . . . . 0.0 111.095 176.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.527 HG23 HD22 ' A' ' 104' ' ' ASN . 15.8 m -147.18 -179.94 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 C-N-CA 125.926 1.69 . . . . 0.0 111.711 -175.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.4 m -125.56 117.78 24.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.828 1.251 . . . . 0.0 111.583 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.81 131.52 34.3 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.625 0.77 . . . . 0.0 111.517 173.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -135.21 115.93 13.89 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.69 1.596 . . . . 0.0 108.437 174.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 56.47 55.82 6.2 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 124.688 1.195 . . . . 0.0 112.416 -171.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.59 24.83 11.7 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 127.551 2.34 . . . . 0.0 114.936 169.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -155.54 131.26 5.51 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.485 1.114 . . . . 0.0 109.567 -176.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -76.29 102.32 1.6 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.975 3.116 . . . . 0.0 112.046 -178.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.404 HG12 ' H ' ' A' ' 51' ' ' TRP . 14.7 m -90.44 -10.21 10.23 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.583 0 CA-C-O 117.728 -1.129 . . . . 0.0 112.494 -179.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -138.58 133.3 32.33 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 120.657 1.571 . . . . 0.0 111.041 -163.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -82.93 144.81 29.77 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 118.288 0.495 . . . . 0.0 110.168 171.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -116.31 -51.78 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.831 0.853 . . . . 0.0 111.652 175.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.81 -177.23 47.27 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 123.564 0.602 . . . . 0.0 113.018 -176.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -124.56 133.3 69.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 124.522 1.129 . . . . 0.0 111.494 -174.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 70.7 -6.58 6.11 Favored Glycine 0 CA--C 1.54 1.619 0 C-N-CA 124.551 1.072 . . . . 0.0 115.616 -177.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.2 t -173.6 169.04 4.37 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 129.538 3.135 . . . . 0.0 109.201 -168.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 79.6 m -103.61 132.18 50.09 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.592 1.557 . . . . 0.0 110.683 173.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.5 84.93 0.74 Allowed Glycine 0 CA--C 1.532 1.142 0 C-N-CA 126.049 1.785 . . . . 0.0 113.056 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.4 t -61.84 164.23 6.6 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.976 1.31 . . . . 0.0 113.01 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 77.19 -42.89 1.94 Allowed Glycine 0 CA--C 1.538 1.523 0 C-N-CA 126.128 1.823 . . . . 0.0 114.859 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 100.28 88.44 1.99 Allowed Glycine 0 CA--C 1.533 1.21 0 C-N-CA 125.759 1.647 . . . . 0.0 112.695 178.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.8 m -56.71 134.9 55.16 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.527 1.531 . . . . 0.0 112.962 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -77.84 35.96 1.65 Allowed Glycine 0 CA--C 1.537 1.461 0 C-N-CA 126.038 1.78 . . . . 0.0 115.707 -174.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 66.2 mt -69.29 140.39 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 125.783 1.633 . . . . 0.0 109.969 -179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 44.6 p90 -135.58 -2.41 2.44 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.341 1.456 . . . . 0.0 114.246 -177.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.85 -21.02 63.39 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.233 1.413 . . . . 0.0 112.78 -177.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -139.69 161.51 37.37 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 126.676 1.991 . . . . 0.0 111.798 173.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.9 m -74.17 -19.99 60.36 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.783 1.233 . . . . 0.0 111.957 168.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.4 t 54.5 30.4 12.9 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.399 1.88 . . . . 0.0 113.713 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 6.2 mp 55.13 75.31 0.32 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 127.499 2.32 . . . . 0.0 112.336 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.9 t -116.62 -39.2 3.35 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 126.108 1.763 . . . . 0.0 113.714 -176.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.87 134.94 37.41 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.486 1.514 . . . . 0.0 111.072 178.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 66.93 11.86 58.93 Favored Glycine 0 CA--C 1.54 1.608 0 C-N-CA 124.583 1.087 . . . . 0.0 115.586 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 39.6 p -104.58 -179.67 4.01 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.495 1.918 . . . . 0.0 111.832 -178.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -153.76 156.53 37.91 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-O 122.554 1.169 . . . . 0.0 111.889 176.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.404 ' H ' HG12 ' A' ' 24' ' ' VAL . 3.6 t-105 -50.27 -37.25 35.14 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.044 1.738 . . . . 0.0 111.813 162.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.62 -27.21 64.48 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.471 1.508 . . . . 0.0 113.019 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.2 p -106.78 -20.5 13.32 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.837 1.655 . . . . 0.0 113.942 174.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -51.3 -40.97 60.14 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.136 1.774 . . . . 0.0 112.557 171.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -58.13 -65.21 0.68 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.779 1.232 . . . . 0.0 110.519 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.3 mptt -61.01 -21.76 63.9 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -177.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 mmtm -63.14 -48.04 80.17 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.1 1.76 . . . . 0.0 113.674 174.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -154.39 21.25 0.48 Allowed 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 115.759 1.762 . . . . 0.0 115.759 -175.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.5 mt -128.47 147.3 33.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 125.354 1.461 . . . . 0.0 109.386 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.2 t -144.71 154.48 42.8 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 176.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -86.63 0.44 54.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 126.076 1.75 . . . . 0.0 112.591 167.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.67 109.88 1.27 Allowed 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 126.443 1.897 . . . . 0.0 111.279 176.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 ttp85 -66.96 104.49 1.39 Allowed 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.473 -1.392 . . . . 0.0 110.304 171.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -114.79 5.7 15.31 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.833 1.653 . . . . 0.0 112.677 175.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 85.7 t -81.73 139.71 17.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 124.241 1.016 . . . . 0.0 111.454 -173.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -126.37 8.07 7.11 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.201 1.8 . . . . 0.0 112.539 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 28.3 m 53.33 40.9 32.0 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.27 2.228 . . . . 0.0 113.487 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -153.16 -26.44 0.15 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 127.818 2.447 . . . . 0.0 112.851 178.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -99.43 -5.11 30.01 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.746 1.218 . . . . 0.0 113.808 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -63.98 -8.24 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.837 1.255 . . . . 0.0 114.136 -179.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 17.2 tmm? -55.71 -31.01 62.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 124.152 0.981 . . . . 0.0 112.677 163.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 49.5 m -88.98 -9.16 52.44 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.572 1.549 . . . . 0.0 114.671 178.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.4 p -106.14 179.15 4.35 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.261 1.425 . . . . 0.0 111.218 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -65.61 -15.59 62.89 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.551 -1.343 . . . . 0.0 114.097 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.9 7.52 8.7 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 127.42 2.288 . . . . 0.0 114.694 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -63.79 -8.06 9.62 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 127.126 2.171 . . . . 0.0 115.093 -173.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 58.7 t60 -61.29 -10.74 7.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.217 1.807 . . . . 0.0 114.796 -174.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.1 t 39.55 62.45 1.18 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.968 2.107 . . . . 0.0 113.249 -165.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.2 159.97 32.02 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.622 1.169 . . . . 0.0 111.741 161.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.54 -31.32 72.32 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.36 1.464 . . . . 0.0 114.625 -171.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.6 ptmm? -160.4 156.49 26.22 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.576 1.55 . . . . 0.0 111.541 168.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -128.22 149.28 50.53 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 123.857 0.863 . . . . 0.0 110.231 168.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.9 m -115.33 91.8 3.72 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.049 0.94 . . . . 0.0 109.769 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -80.25 128.12 33.16 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 121.278 0.561 . . . . 0.0 111.266 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 82.6 mt -105.93 113.69 43.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 C-N-CA 126.001 1.721 . . . . 0.0 107.432 176.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -84.24 89.08 7.27 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.676 -0.64 . . . . 0.0 110.022 168.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 64.3 p -149.07 164.49 34.48 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.511 1.124 . . . . 0.0 112.811 171.446 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -76.45 161.77 73.39 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.701 1.2 . . . . 0.0 110.611 171.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -68.99 -21.35 37.2 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.028 1.819 . . . . 0.0 114.563 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.95 -57.38 21.67 Favored Pre-proline 0 CA--C 1.546 0.791 0 CA-C-N 119.483 1.038 . . . . 0.0 113.015 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.2 -0.46 5.69 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.446 2.764 . . . . 0.0 115.157 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -101.41 -56.42 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 126.275 1.83 . . . . 0.0 109.577 175.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.04 -43.76 86.62 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 121.229 -0.919 . . . . 0.0 113.031 -179.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.93 -3.28 34.61 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 64.5 mt -53.5 -35.8 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.529 0.732 . . . . 0.0 110.615 170.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.0 p -109.02 159.26 16.98 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.284 1.034 . . . . 0.0 113.262 174.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -153.91 102.07 2.48 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.845 1.658 . . . . 0.0 110.577 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.85 5.47 87.91 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.175 0.893 . . . . 0.0 114.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.8 mt -73.82 115.68 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 CA-C-N 118.635 1.217 . . . . 0.0 111.177 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -109.42 -12.1 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 C-N-CA 126.614 1.966 . . . . 0.0 110.809 171.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.15 5.68 4.18 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 127.477 2.311 . . . . 0.0 116.217 -170.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 19.0 t 52.38 64.87 1.69 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.446 1.498 . . . . 0.0 112.741 -173.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -156.13 158.05 37.03 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 126.279 1.832 . . . . 0.0 111.058 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.527 HD22 HG23 ' A' ' 16' ' ' VAL . 6.0 t-20 -144.34 -169.59 3.17 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 120.747 -1.22 . . . . 0.0 111.839 163.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.5 t -124.84 141.37 45.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 125.681 1.592 . . . . 0.0 108.735 171.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 29.2 tp -50.73 141.6 12.69 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.682 1.193 . . . . 0.0 111.889 170.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.58 171.49 1.98 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 173.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 7.1 t -122.4 -20.46 6.09 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.804 1.242 . . . . 0.0 114.017 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 41.1 m -83.96 170.37 14.06 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.07 1.348 . . . . 0.0 111.63 174.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -117.57 106.02 12.68 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.576 1.151 . . . . 0.0 111.023 -178.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -98.93 159.2 15.12 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.714 1.606 . . . . 0.0 110.341 -174.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -70.52 106.94 3.63 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.944 -0.472 . . . . 0.0 110.232 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -98.48 132.31 44.02 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.952 1.301 . . . . 0.0 111.789 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 33.4 t -136.11 93.57 2.93 Favored 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 124.746 1.219 . . . . 0.0 109.87 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -88.8 159.28 17.82 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.733 0.813 . . . . 0.0 110.488 171.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.07 139.79 29.13 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 124.257 1.023 . . . . 0.0 109.371 161.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -124.13 125.94 45.34 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.545 1.138 . . . . 0.0 110.573 -174.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 32.8 t -57.07 145.34 7.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.561 0.744 . . . . 0.0 111.634 -178.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.2 t -135.9 105.69 6.2 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.471 1.108 . . . . 0.0 111.453 173.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 12.6 t . . . . . 0 C--O 1.254 1.33 0 C-N-CA 126.539 1.936 . . . . 0.0 111.56 -179.402 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 119.296 -0.383 . . . . 0.0 110.634 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -81.13 -46.4 0.08 OUTLIER 'Trans proline' 0 CA--C 1.544 0.982 0 C-N-CA 121.994 1.796 . . . . 0.0 114.126 -164.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 45.6 m -135.18 165.97 24.18 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.804 2.042 . . . . 0.0 109.817 171.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.549 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.6 mmpt? -95.34 142.74 27.37 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.942 0.897 . . . . 0.0 110.983 173.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -136.91 156.14 48.85 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.509 1.524 . . . . 0.0 110.995 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.97 151.64 19.4 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.17 1.388 . . . . 0.0 112.302 172.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.6 110.31 16.85 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.743 2.017 . . . . 0.0 111.372 -174.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.4 tppp? -130.36 116.97 19.04 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.544 1.537 . . . . 0.0 111.466 175.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.0 mmtm -130.35 150.43 51.59 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.968 1.707 . . . . 0.0 110.835 174.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 10.8 m -156.69 173.9 16.27 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.198 1.799 . . . . 0.0 111.43 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -144.27 101.49 3.71 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.067 -1.021 . . . . 0.0 110.861 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.13 175.8 8.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.192 1.397 . . . . 0.0 113.108 -176.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.417 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -65.21 170.02 5.04 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 128.162 2.585 . . . . 0.0 113.276 172.545 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.6 p90 -140.37 143.76 35.89 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.736 1.614 . . . . 0.0 111.811 -179.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.7 t -102.21 143.99 31.3 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.916 0.865 . . . . 0.0 111.232 175.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -147.5 -178.05 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.455 1.902 . . . . 0.0 111.597 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.3 m -126.91 115.4 19.22 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.768 1.227 . . . . 0.0 111.612 177.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.9 t -83.29 129.87 35.03 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.113 0.965 . . . . 0.0 111.497 176.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -140.11 113.0 8.13 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.51 1.124 . . . . 0.0 108.538 177.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 57.7 59.46 3.22 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 125.522 1.529 . . . . 0.0 113.025 -169.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.7 mp0 62.84 26.46 15.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.599 2.359 . . . . 0.0 114.8 169.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.43 134.7 5.8 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 125.317 1.447 . . . . 0.0 109.559 -176.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.41 107.97 2.6 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 123.644 2.896 . . . . 0.0 113.072 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.446 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.9 m -108.31 17.58 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 126.777 2.031 . . . . 0.0 112.603 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.1 t-80 -153.27 140.53 19.52 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 120.137 1.335 . . . . 0.0 110.589 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 18.1 t80 -86.07 148.2 25.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.928 0.491 . . . . 0.0 110.387 170.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.4 t -119.0 -58.8 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 123.675 0.79 . . . . 0.0 111.771 173.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.86 -172.3 42.18 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-N 118.537 0.608 . . . . 0.0 114.089 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.2 t -128.77 123.99 60.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.179 1.392 . . . . 0.0 109.891 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.3 3.49 25.2 Favored Glycine 0 CA--C 1.541 1.713 0 N-CA-C 116.012 1.165 . . . . 0.0 116.012 -175.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 99.0 p -165.87 164.89 18.55 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 127.15 2.18 . . . . 0.0 111.42 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 93.1 m -112.72 108.64 17.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.631 1.572 . . . . 0.0 110.611 171.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -90.12 164.36 30.96 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 123.971 0.796 . . . . 0.0 112.617 171.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.1 t -154.18 179.93 8.5 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.959 1.304 . . . . 0.0 111.721 174.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -151.69 172.22 31.12 Favored Glycine 0 CA--C 1.535 1.3 0 C-N-CA 125.624 1.583 . . . . 0.0 113.475 177.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -129.96 21.04 5.01 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 125.828 1.68 . . . . 0.0 114.808 -175.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.5 m -125.35 164.85 19.49 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.97 1.708 . . . . 0.0 112.423 -173.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -76.2 21.99 2.12 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 126.017 1.77 . . . . 0.0 115.864 -177.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 90.7 mt -65.0 147.69 12.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 126.59 1.956 . . . . 0.0 110.52 -178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -140.62 14.53 2.34 Favored 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 125.081 1.352 . . . . 0.0 113.346 -176.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.56 -15.35 63.51 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 114.381 1.252 . . . . 0.0 114.381 -176.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.68 169.87 3.7 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.212 1.005 . . . . 0.0 113.388 169.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 36.3 m -70.17 -20.54 63.12 Favored 'General case' 0 N--CA 1.48 1.061 0 O-C-N 120.917 -1.115 . . . . 0.0 113.147 176.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 80.3 p 46.1 43.07 10.51 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.115 2.166 . . . . 0.0 115.007 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.5 mp -55.03 -20.8 10.22 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.62 1.568 . . . . 0.0 114.299 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 11.0 p -55.34 -33.15 63.11 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.333 1.853 . . . . 0.0 114.692 173.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.09 104.1 8.67 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.624 1.57 . . . . 0.0 111.362 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.21 -0.19 50.8 Favored Glycine 0 CA--C 1.537 1.423 0 C-N-CA 125.441 1.496 . . . . 0.0 115.193 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -137.09 -165.87 1.82 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.284 1.433 . . . . 0.0 111.032 173.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -155.12 171.94 18.96 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.903 1.681 . . . . 0.0 109.558 -178.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.446 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.2 t-105 -55.07 -36.64 65.83 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.142 1.777 . . . . 0.0 112.185 169.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.88 -37.34 76.35 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.866 1.266 . . . . 0.0 112.195 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.1 p -89.47 -27.91 20.03 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.542 1.137 . . . . 0.0 113.521 174.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -52.05 -44.4 64.25 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.787 1.635 . . . . 0.0 113.067 174.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -56.02 -63.06 1.3 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.254 1.022 . . . . 0.0 110.571 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -60.36 -20.01 57.83 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.488 1.292 . . . . 0.0 114.488 -178.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.6 tmtt? -70.11 -46.87 63.9 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.123 1.369 . . . . 0.0 113.311 177.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -153.04 23.65 0.56 Allowed 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -176.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.4 mt -128.62 147.8 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 O-C-N 120.147 -1.596 . . . . 0.0 109.299 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -147.78 155.68 41.94 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.678 0.992 . . . . 0.0 113.678 177.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -89.07 2.31 54.27 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.255 1.822 . . . . 0.0 112.814 167.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.1 t -160.18 114.41 2.22 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.185 1.794 . . . . 0.0 111.23 175.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 20.9 ttp-105 -66.47 103.21 1.0 Allowed 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.669 -1.27 . . . . 0.0 110.45 172.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -112.83 2.89 16.12 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.059 1.344 . . . . 0.0 113.45 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.419 HG22 ' H ' ' A' ' 67' ' ' CYS . 8.2 p -75.54 145.06 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 C-N-CA 124.355 1.062 . . . . 0.0 112.398 178.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -130.32 8.08 5.03 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.112 1.765 . . . . 0.0 112.703 172.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.419 ' H ' HG22 ' A' ' 65' ' ' VAL . 21.4 m 48.37 50.85 16.04 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.895 2.478 . . . . 0.0 113.238 -176.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.43 -17.01 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 127.366 2.266 . . . . 0.0 113.202 178.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -110.26 -2.99 16.49 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.936 1.695 . . . . 0.0 113.767 178.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -63.98 -8.66 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 125.637 1.575 . . . . 0.0 113.913 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 5.3 ppp? -53.01 -22.51 5.83 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 162.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.8 t -98.07 -21.26 16.88 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.487 1.515 . . . . 0.0 113.995 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.1 p -87.35 -177.7 6.01 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.603 1.161 . . . . 0.0 111.849 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -63.22 -20.53 65.51 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 120.832 -1.168 . . . . 0.0 113.646 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.79 21.81 3.39 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.569 1.948 . . . . 0.0 113.326 -175.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -63.6 -7.03 6.15 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 126.092 1.757 . . . . 0.0 114.663 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 66.0 t60 -64.7 -6.46 7.92 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 125.583 1.553 . . . . 0.0 114.653 -177.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 54.31 33.6 18.72 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.187 1.795 . . . . 0.0 114.476 -177.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.53 158.18 3.52 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.061 1.745 . . . . 0.0 113.926 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.04 -35.69 81.07 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.435 1.494 . . . . 0.0 114.877 -173.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.8 ptmt -161.18 163.44 31.19 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.185 1.394 . . . . 0.0 112.774 165.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -131.63 166.18 22.02 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.979 0.912 . . . . 0.0 111.336 166.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.0 m -126.73 93.84 3.89 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.734 1.214 . . . . 0.0 109.404 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -77.95 122.64 25.78 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.259 0.624 . . . . 0.0 110.759 174.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 84.6 mt -98.64 114.52 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 C-N-CA 124.954 1.302 . . . . 0.0 107.848 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -87.02 86.1 7.29 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.386 0.612 . . . . 0.0 110.122 167.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.5 p -145.87 166.66 25.31 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.897 1.279 . . . . 0.0 112.205 168.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 17.6 mtt180 -73.29 164.47 60.73 Favored Pre-proline 0 N--CA 1.473 0.719 0 C-N-CA 124.406 1.082 . . . . 0.0 111.325 168.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.91 -23.19 25.83 Favored 'Trans proline' 0 CA--C 1.54 0.786 0 C-N-CA 122.747 2.298 . . . . 0.0 114.521 174.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -59.57 -58.49 19.09 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 124.61 1.164 . . . . 0.0 112.806 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.56 0.73 5.08 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.307 2.671 . . . . 0.0 114.926 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 25.6 t -103.3 -55.57 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 126.604 1.962 . . . . 0.0 109.82 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -43.07 85.11 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.208 -0.933 . . . . 0.0 112.769 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.64 -5.58 46.18 Favored 'General case' 0 CA--C 1.539 0.558 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -173.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.5 mt -53.49 -36.01 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.598 0.759 . . . . 0.0 110.58 171.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 23.6 p -111.5 158.44 19.16 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.805 1.242 . . . . 0.0 113.057 173.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.7 tptt -155.77 105.97 2.44 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.742 1.617 . . . . 0.0 110.579 179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.35 5.62 86.94 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 123.984 0.802 . . . . 0.0 114.733 -178.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 44.4 mt -77.45 116.53 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 124.676 1.19 . . . . 0.0 110.87 -178.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 7.5 mt -111.33 -12.52 11.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 126.768 2.027 . . . . 0.0 110.879 175.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -74.32 7.67 2.68 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 127.633 2.373 . . . . 0.0 116.095 -170.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 5.9 t 49.69 66.11 1.22 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.996 1.318 . . . . 0.0 113.276 -171.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 61.1 tttt -159.37 157.46 30.39 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 125.352 1.461 . . . . 0.0 111.356 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -145.01 -169.11 3.11 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.576 -1.327 . . . . 0.0 112.067 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 16.8 t -125.74 143.2 40.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 126.127 1.771 . . . . 0.0 108.865 172.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.5 tp -50.78 141.91 12.32 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.559 1.143 . . . . 0.0 111.982 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.94 172.9 1.53 Allowed 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 172.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 8.8 t -120.37 -28.85 4.93 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.799 1.24 . . . . 0.0 113.573 179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.9 m -76.96 171.7 14.37 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.419 1.488 . . . . 0.0 111.845 173.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -123.04 110.4 15.29 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.118 0.967 . . . . 0.0 111.144 -175.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -105.98 159.67 15.87 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 126.157 1.783 . . . . 0.0 110.245 -171.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -69.64 109.54 4.38 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.337 0.589 . . . . 0.0 110.513 178.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.03 123.18 44.81 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.283 1.433 . . . . 0.0 111.231 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 34.9 t -126.71 93.61 3.83 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.436 1.494 . . . . 0.0 110.686 -173.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.02 163.45 16.28 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.463 0.649 . . . . 0.0 110.329 173.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -150.96 138.77 19.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 158.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -126.74 134.6 50.6 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.931 1.292 . . . . 0.0 109.271 -175.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 29.2 t -60.9 149.93 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 123.556 0.742 . . . . 0.0 111.816 -178.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.7 t -134.52 106.64 7.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.22 1.408 . . . . 0.0 110.933 171.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.253 1.262 0 C-N-CA 126.244 1.818 . . . . 0.0 112.602 179.839 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.0 ptt180 . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -72.95 -50.04 0.22 Allowed 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 121.612 1.541 . . . . 0.0 111.521 172.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -145.84 179.28 7.57 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.61 2.364 . . . . 0.0 109.574 -176.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -110.16 131.16 55.31 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.644 1.178 . . . . 0.0 110.733 -177.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -134.84 161.94 33.79 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 125.222 1.409 . . . . 0.0 111.924 -176.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -107.55 151.13 26.01 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 126.002 1.721 . . . . 0.0 112.764 177.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.74 113.36 16.75 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.555 1.942 . . . . 0.0 111.487 -172.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.5 tptt -139.55 109.45 6.36 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.39 1.476 . . . . 0.0 111.883 -179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -118.12 153.81 33.17 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.417 1.487 . . . . 0.0 111.637 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.0 m -156.21 172.19 18.89 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.17 1.788 . . . . 0.0 111.557 175.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.7 m -141.26 104.91 4.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.869 0.868 . . . . 0.0 110.569 174.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.415 HD21 ' HG ' ' A' ' 113' ' ' LEU . 0.4 OUTLIER -169.42 172.43 7.13 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.682 1.193 . . . . 0.0 113.664 -170.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.79 174.28 0.85 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 128.271 2.628 . . . . 0.0 114.397 167.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.4 p90 -145.01 147.06 32.21 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.682 1.993 . . . . 0.0 111.726 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 34.3 t -108.37 134.94 50.48 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.869 1.268 . . . . 0.0 111.404 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.3 m -141.79 -178.68 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 125.935 1.694 . . . . 0.0 111.707 -173.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.431 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 2.1 m -129.86 115.04 16.66 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 121.457 -0.777 . . . . 0.0 111.785 178.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.3 t -83.0 128.54 34.57 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.53 1.132 . . . . 0.0 111.254 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -138.23 112.16 8.42 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 124.682 1.193 . . . . 0.0 108.45 177.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m-80 56.05 60.52 3.18 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.61 1.564 . . . . 0.0 112.968 -169.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 63.46 27.06 15.08 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 127.719 2.408 . . . . 0.0 114.751 168.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -159.17 133.8 5.45 Favored Pre-proline 0 CA--C 1.543 0.678 0 C-N-CA 125.262 1.425 . . . . 0.0 109.519 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -75.86 105.12 2.02 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.809 3.006 . . . . 0.0 112.137 177.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.2 m -97.84 14.33 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 C-N-CA 124.834 1.254 . . . . 0.0 111.997 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.431 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 24.7 t-80 -158.42 147.73 19.29 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 120.328 1.422 . . . . 0.0 113.025 -167.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -108.77 128.0 54.5 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 125.007 1.323 . . . . 0.0 111.009 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 48.4 t -93.66 -58.24 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.027 0.931 . . . . 0.0 110.97 174.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.77 -175.58 46.62 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.448 1.023 . . . . 0.0 112.652 -172.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.9 p -122.79 136.86 58.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 124.43 1.092 . . . . 0.0 111.84 -172.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 67.96 -5.36 3.67 Favored Glycine 0 CA--C 1.541 1.714 0 N-CA-C 116.2 1.24 . . . . 0.0 116.2 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -172.5 165.46 5.65 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 129.929 3.292 . . . . 0.0 109.527 -171.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 83.9 m -101.8 112.22 24.75 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.042 1.337 . . . . 0.0 110.427 173.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.27 80.59 0.27 Allowed Glycine 0 CA--C 1.532 1.138 0 C-N-CA 125.6 1.571 . . . . 0.0 112.924 -174.042 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.4 t -89.99 173.97 7.92 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.546 1.139 . . . . 0.0 113.415 179.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 120.05 149.5 8.37 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 127.562 2.505 . . . . 0.0 113.678 176.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 151.79 165.09 12.72 Favored Glycine 0 CA--C 1.538 1.486 0 C-N-CA 125.724 1.631 . . . . 0.0 113.686 176.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 70.6 m -143.52 90.71 2.18 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.384 1.474 . . . . 0.0 111.521 -172.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.65 5.01 67.37 Favored Glycine 0 CA--C 1.541 1.715 0 C-N-CA 124.521 1.058 . . . . 0.0 115.101 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 90.4 mt -72.26 144.32 13.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 126.499 1.92 . . . . 0.0 110.095 -178.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 19.1 p90 -137.64 15.01 2.93 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.33 1.452 . . . . 0.0 114.049 -177.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.1 mp -61.52 -20.99 63.83 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 126.038 1.735 . . . . 0.0 114.313 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.18 167.15 6.9 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.199 1.4 . . . . 0.0 113.458 170.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.4 m -73.78 -20.67 60.41 Favored 'General case' 0 N--CA 1.479 0.975 0 O-C-N 120.724 -1.235 . . . . 0.0 113.473 176.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 95.4 p 48.09 36.62 6.72 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 127.447 2.299 . . . . 0.0 116.044 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -48.85 -28.12 3.52 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 126.257 1.823 . . . . 0.0 114.452 177.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.9 t -57.72 -21.72 42.4 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.191 1.396 . . . . 0.0 114.347 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.17 107.84 10.75 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.468 1.507 . . . . 0.0 111.056 172.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.11 1.21 61.3 Favored Glycine 0 CA--C 1.538 1.502 0 C-N-CA 125.055 1.312 . . . . 0.0 115.375 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -137.66 -165.09 1.72 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.456 1.502 . . . . 0.0 111.438 174.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -154.02 173.61 15.78 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.394 1.478 . . . . 0.0 110.845 -175.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -56.78 -36.99 70.48 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 127.186 2.194 . . . . 0.0 112.215 167.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.77 -43.47 90.4 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.699 1.2 . . . . 0.0 111.587 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 13.6 p -82.93 -29.3 29.26 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.099 1.36 . . . . 0.0 113.532 174.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.56 -43.87 65.5 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.389 1.476 . . . . 0.0 112.699 175.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -57.12 -61.58 2.36 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.12 0.968 . . . . 0.0 110.536 173.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -59.66 -19.86 52.27 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.499 1.296 . . . . 0.0 114.499 -178.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -70.32 -48.44 56.52 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.764 1.626 . . . . 0.0 112.986 175.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -152.34 22.85 0.63 Allowed 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.8 mt -128.08 144.16 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 120.439 -1.413 . . . . 0.0 109.534 178.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 13.4 t -143.36 156.39 44.67 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 113.73 1.011 . . . . 0.0 113.73 178.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -91.42 0.83 57.46 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.396 1.878 . . . . 0.0 112.487 167.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.3 t -162.8 112.29 1.38 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 126.338 1.855 . . . . 0.0 111.185 175.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.8 ttp-105 -68.0 107.34 2.65 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.545 -1.347 . . . . 0.0 110.673 173.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -115.47 1.57 13.68 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.142 1.377 . . . . 0.0 113.687 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.0 p -69.92 142.9 15.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 125.07 1.348 . . . . 0.0 112.516 178.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -130.96 12.16 5.17 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 126.268 1.827 . . . . 0.0 112.424 169.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 6.9 m 51.48 40.93 27.9 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 128.034 2.534 . . . . 0.0 113.152 -175.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -153.25 -38.68 0.1 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.379 2.271 . . . . 0.0 111.362 -174.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -90.97 -8.3 49.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.369 1.067 . . . . 0.0 113.493 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.0 pt -62.15 -10.59 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.347 1.059 . . . . 0.0 113.721 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.83 -36.04 35.4 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.82 1.648 . . . . 0.0 113.451 166.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 96.0 p -87.3 -14.5 40.68 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.623 1.342 . . . . 0.0 114.623 177.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.6 p -86.17 -178.84 6.61 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.221 1.408 . . . . 0.0 111.869 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -70.88 -12.43 61.54 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 171.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -85.93 10.02 15.22 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 127.031 2.132 . . . . 0.0 114.989 -176.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -67.49 -7.49 26.07 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 127.978 2.511 . . . . 0.0 114.605 -171.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -61.79 0.54 0.35 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.237 2.615 . . . . 0.0 115.846 -174.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 4.6 t 56.15 30.96 17.38 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.233 1.813 . . . . 0.0 114.2 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.57 154.85 27.63 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.973 1.309 . . . . 0.0 112.616 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -63.96 -33.72 76.36 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.922 1.289 . . . . 0.0 114.322 -169.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.3 pttm -162.01 163.79 28.66 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.559 1.544 . . . . 0.0 111.901 166.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -132.94 159.31 40.34 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.574 0.749 . . . . 0.0 110.674 165.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.0 m -122.73 90.41 3.29 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.363 1.065 . . . . 0.0 110.332 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -77.42 119.93 21.72 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.638 0.775 . . . . 0.0 111.134 178.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.6 mt -96.08 112.92 29.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 125.645 1.578 . . . . 0.0 107.65 173.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -80.5 89.61 5.64 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 121.532 -0.73 . . . . 0.0 109.783 167.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 62.0 m -149.0 159.2 44.44 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.56 1.144 . . . . 0.0 112.981 174.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 25.8 mtt-85 -71.14 163.79 62.55 Favored Pre-proline 0 N--CA 1.472 0.635 0 C-N-CA 124.575 1.15 . . . . 0.0 111.115 164.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.59 -24.2 30.69 Favored 'Trans proline' 0 CA--C 1.535 0.574 0 C-N-CA 122.301 2.0 . . . . 0.0 114.201 176.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.61 -56.37 30.35 Favored Pre-proline 0 CA--C 1.545 0.782 0 CA-C-O 117.921 -1.038 . . . . 0.0 113.091 -175.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.79 -0.39 6.87 Favored 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.983 2.455 . . . . 0.0 114.826 178.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.3 t -102.9 -54.44 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.323 1.849 . . . . 0.0 109.749 177.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -45.53 78.55 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 121.209 -0.932 . . . . 0.0 112.848 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.73 -3.56 35.5 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -172.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.09 -35.68 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 C-N-CA 123.642 0.777 . . . . 0.0 110.599 169.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 24.3 p -111.07 157.42 20.0 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.864 1.266 . . . . 0.0 113.217 172.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -155.37 106.25 2.54 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.583 1.953 . . . . 0.0 109.875 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.6 3.24 86.49 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.39 0.995 . . . . 0.0 114.754 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 52.2 mt -76.12 116.05 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 124.706 1.202 . . . . 0.0 110.86 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 17.9 mt -105.54 -18.2 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.925 0 C-N-CA 126.447 1.899 . . . . 0.0 110.807 173.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.12 8.87 1.12 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 128.095 2.558 . . . . 0.0 116.909 -166.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 8.7 t 50.7 62.08 2.89 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-N 119.895 1.225 . . . . 0.0 113.48 -173.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -157.55 154.62 28.87 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 125.919 1.687 . . . . 0.0 111.242 175.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -138.09 -170.54 2.82 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 120.869 -1.145 . . . . 0.0 111.534 168.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.3 t -122.85 141.92 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 125.75 1.62 . . . . 0.0 108.524 173.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 28.6 tp -51.01 140.96 14.66 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.29 1.036 . . . . 0.0 111.72 169.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.58 170.85 2.92 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 122.583 1.183 . . . . 0.0 113.508 172.193 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.8 p -118.26 -30.89 5.14 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 126.567 1.947 . . . . 0.0 113.353 -176.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.5 m -80.52 171.08 15.5 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.711 1.604 . . . . 0.0 112.086 175.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -118.48 110.09 17.0 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.796 1.238 . . . . 0.0 111.164 -176.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -104.75 161.08 14.47 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.809 1.644 . . . . 0.0 110.374 -173.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -71.47 109.14 5.25 Favored 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.876 -0.515 . . . . 0.0 110.417 -179.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.415 ' HG ' HD21 ' A' ' 12' ' ' ASN . 0.3 OUTLIER -101.28 126.62 48.05 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.668 1.187 . . . . 0.0 112.003 -176.804 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 30.1 t -128.76 91.48 3.23 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 125.326 1.45 . . . . 0.0 109.855 -174.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -82.21 161.85 22.59 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.851 0.834 . . . . 0.0 110.407 169.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -151.58 128.73 11.15 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.04 -1.037 . . . . 0.0 109.484 157.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -116.96 136.87 52.61 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.406 1.083 . . . . 0.0 110.114 -173.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 20.6 t -60.5 147.35 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 CA-C-O 121.451 0.643 . . . . 0.0 112.043 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.8 t -137.64 101.8 4.58 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.049 1.34 . . . . 0.0 111.269 172.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 23.0 p . . . . . 0 C--O 1.254 1.305 0 C-N-CA 126.591 1.956 . . . . 0.0 114.403 178.93 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 56.6 mtm180 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 119.285 -0.388 . . . . 0.0 110.455 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -74.73 -51.22 0.13 Allowed 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.44 2.093 . . . . 0.0 113.522 -168.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 73.8 m -137.68 -167.34 2.11 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.752 2.421 . . . . 0.0 109.217 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.12 149.41 42.81 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.736 1.214 . . . . 0.0 109.845 167.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -142.73 159.08 42.93 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.888 1.675 . . . . 0.0 110.213 -176.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -99.11 157.21 16.51 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.481 1.112 . . . . 0.0 113.061 176.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.95 103.35 14.59 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.367 1.467 . . . . 0.0 111.093 -169.307 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -127.98 114.72 17.49 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.457 1.503 . . . . 0.0 111.118 -178.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -130.86 147.67 52.54 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.05 1.74 . . . . 0.0 110.865 176.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 18.6 t -151.11 170.3 19.75 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.842 1.657 . . . . 0.0 110.987 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.4 m -139.7 100.86 4.06 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 121.479 -0.763 . . . . 0.0 110.768 173.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.93 176.74 9.13 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.833 1.253 . . . . 0.0 113.519 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.25 170.3 3.87 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 127.471 2.308 . . . . 0.0 113.608 171.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 20.9 p90 -141.15 142.18 34.08 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 126.122 1.769 . . . . 0.0 111.541 -179.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.5 t -100.52 142.71 31.62 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.801 0.81 . . . . 0.0 111.413 174.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.483 HG23 HD22 ' A' ' 104' ' ' ASN . 16.8 m -147.24 -178.3 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 126.564 1.945 . . . . 0.0 110.983 -178.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -126.49 117.37 22.74 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.93 1.292 . . . . 0.0 111.532 177.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -87.1 133.0 33.66 Favored 'General case' 0 N--CA 1.466 0.365 0 C-N-CA 123.658 0.783 . . . . 0.0 111.704 174.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -139.89 113.63 8.69 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.261 1.425 . . . . 0.0 108.501 176.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 59.47 56.7 3.6 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.402 1.481 . . . . 0.0 112.416 -169.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 64.12 24.81 13.57 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 127.629 2.372 . . . . 0.0 115.1 169.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.1 132.7 5.32 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 124.855 1.262 . . . . 0.0 109.639 -174.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.45 109.05 2.79 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.565 2.843 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.453 HG12 ' N ' ' A' ' 51' ' ' TRP . 4.0 m -108.52 18.2 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 126.692 1.997 . . . . 0.0 112.518 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -156.51 137.31 13.37 Favored 'General case' 0 N--CA 1.476 0.826 0 O-C-N 120.659 -1.276 . . . . 0.0 110.826 -178.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -80.69 153.82 27.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 118.056 0.389 . . . . 0.0 110.452 167.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.9 -54.54 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 124.216 1.006 . . . . 0.0 112.155 171.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.45 -172.28 43.43 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-N 119.259 0.936 . . . . 0.0 114.677 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -125.91 129.04 72.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 125.413 1.485 . . . . 0.0 109.99 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.17 -4.58 4.56 Favored Glycine 0 CA--C 1.539 1.565 0 N-CA-C 116.664 1.426 . . . . 0.0 116.664 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.0 m -162.43 162.96 27.88 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.558 3.143 . . . . 0.0 109.869 -172.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 90.2 m -106.6 120.19 41.29 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.212 1.405 . . . . 0.0 109.771 167.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.44 145.56 50.0 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 123.358 0.504 . . . . 0.0 112.233 172.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.5 t -145.35 159.77 42.55 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.072 1.349 . . . . 0.0 111.476 178.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 154.16 -173.27 32.75 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.475 1.512 . . . . 0.0 113.253 -174.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -142.78 88.85 0.18 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 125.487 1.517 . . . . 0.0 112.137 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 91.6 p -136.13 169.85 16.96 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.716 1.606 . . . . 0.0 112.946 -178.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -104.39 16.41 48.85 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.853 1.692 . . . . 0.0 115.062 -175.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 73.0 mt -62.83 137.13 24.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.458 1.503 . . . . 0.0 110.748 -174.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 30.9 p90 -135.68 5.94 3.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 126.087 1.755 . . . . 0.0 113.675 -175.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -73.57 -16.12 61.26 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.64 1.576 . . . . 0.0 112.612 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -67.64 163.64 20.93 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.068 1.347 . . . . 0.0 113.093 176.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 33.3 m -66.65 -33.75 76.35 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.012 0.925 . . . . 0.0 111.824 175.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.8 t 34.27 71.61 0.1 Allowed 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 128.631 2.772 . . . . 0.0 114.036 -172.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.2 mp -57.79 -10.63 1.76 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.87 1.668 . . . . 0.0 115.111 -178.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.2 p -57.76 -38.88 76.18 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.035 1.334 . . . . 0.0 114.138 171.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -117.33 107.13 14.01 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.073 1.749 . . . . 0.0 110.951 -178.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.96 2.58 62.51 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 124.954 1.264 . . . . 0.0 115.264 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.21 -166.99 2.08 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.986 1.393 . . . . 0.0 111.482 173.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -153.98 173.38 16.06 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.563 1.545 . . . . 0.0 110.348 -178.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.453 ' N ' HG12 ' A' ' 24' ' ' VAL . 1.6 t-105 -56.67 -36.57 69.74 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.481 1.912 . . . . 0.0 112.357 168.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.55 -45.08 89.7 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.034 1.334 . . . . 0.0 111.413 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.2 p -80.43 -30.94 37.64 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.854 1.262 . . . . 0.0 113.427 173.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -53.49 -44.14 68.79 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.318 1.447 . . . . 0.0 113.131 177.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -53.45 -61.58 2.21 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.147 0.979 . . . . 0.0 110.421 172.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.7 mmtp -59.29 -20.06 51.29 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 178.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.6 tptt -72.66 -52.7 14.25 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.155 1.782 . . . . 0.0 113.856 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 20.9 m-70 -133.14 7.88 3.99 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 116.565 2.061 . . . . 0.0 116.565 -175.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.4 mt -127.5 147.5 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 120.541 -1.349 . . . . 0.0 110.108 -172.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 12.5 t -143.34 154.99 44.31 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 174.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 59.0 m-80 -91.18 0.52 57.51 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.194 1.798 . . . . 0.0 112.359 168.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.45 114.3 2.14 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.196 1.799 . . . . 0.0 111.192 174.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 25.7 ttp-105 -67.93 103.39 1.47 Allowed 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.563 -1.336 . . . . 0.0 110.506 172.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -113.56 4.85 16.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.447 1.499 . . . . 0.0 113.046 177.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.6 t -79.74 142.55 13.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 124.434 1.093 . . . . 0.0 111.47 -176.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -128.71 9.66 5.95 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.032 1.733 . . . . 0.0 112.504 175.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 15.8 m 52.49 44.34 30.08 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.52 2.328 . . . . 0.0 113.043 -178.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.7 -25.13 0.06 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.992 2.117 . . . . 0.0 113.245 -177.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -101.05 -5.05 26.28 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.751 1.22 . . . . 0.0 113.717 176.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.3 pt -61.41 -11.96 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.89 1.276 . . . . 0.0 114.005 -177.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 13.4 tmm? -57.37 -28.9 63.58 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.832 0.853 . . . . 0.0 112.923 167.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.5 t -83.82 1.26 43.92 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 126.01 1.724 . . . . 0.0 114.234 175.164 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.0 p -117.4 -177.02 3.13 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 125.611 1.565 . . . . 0.0 111.882 -175.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 54.0 m-80 -63.48 -17.85 63.16 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.14 -0.975 . . . . 0.0 113.539 171.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -92.77 11.71 25.99 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.204 1.802 . . . . 0.0 114.199 -170.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -63.3 -8.84 9.49 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.789 2.435 . . . . 0.0 115.313 -175.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -62.28 -10.11 9.96 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.082 1.753 . . . . 0.0 114.759 -173.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 46.1 t 39.66 59.01 1.93 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.994 2.117 . . . . 0.0 113.234 -166.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.88 161.13 27.02 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.888 1.275 . . . . 0.0 111.743 162.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -63.88 -34.06 77.1 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.198 1.399 . . . . 0.0 114.381 -172.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.9 ptmt -160.02 157.05 28.02 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.7 1.6 . . . . 0.0 111.889 167.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -121.44 152.89 38.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.551 0.74 . . . . 0.0 109.42 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 59.5 m -112.36 98.13 7.08 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.017 1.327 . . . . 0.0 108.035 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -82.05 136.33 35.23 Favored 'General case' 0 C--O 1.234 0.267 0 O-C-N 121.593 -0.692 . . . . 0.0 111.873 176.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 64.5 mt -109.12 109.7 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 125.942 1.697 . . . . 0.0 107.029 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -82.34 89.23 6.56 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.536 -0.727 . . . . 0.0 109.456 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 50.4 m -149.52 160.21 43.66 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.972 1.309 . . . . 0.0 112.687 177.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 39.5 mtt180 -70.16 163.42 61.86 Favored Pre-proline 0 N--CA 1.47 0.546 0 C-N-CA 124.326 1.05 . . . . 0.0 111.187 164.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.35 -23.55 27.97 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 122.312 2.008 . . . . 0.0 114.229 176.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.27 -57.7 23.92 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.088 -177.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -69.74 0.62 5.36 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.062 2.508 . . . . 0.0 114.855 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.9 t -103.27 -54.65 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 126.522 1.929 . . . . 0.0 109.748 176.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -46.01 76.29 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.129 -0.982 . . . . 0.0 112.745 179.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.44 -3.08 31.81 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -172.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 59.5 mt -53.19 -36.39 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 C-N-CA 123.558 0.743 . . . . 0.0 110.403 168.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -107.96 159.0 16.88 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.084 0.954 . . . . 0.0 113.409 174.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.95 106.69 2.87 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.438 1.895 . . . . 0.0 109.779 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.53 5.08 90.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 124.301 0.953 . . . . 0.0 114.987 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.6 mt -75.85 116.11 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 124.646 1.179 . . . . 0.0 111.226 -176.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.2 mt -110.82 -10.94 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 126.577 1.951 . . . . 0.0 111.008 172.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.14 3.76 5.22 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.447 2.299 . . . . 0.0 116.061 -171.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.6 t 52.98 64.46 1.85 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.695 1.598 . . . . 0.0 112.717 -172.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -155.79 158.81 38.75 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 126.816 2.046 . . . . 0.0 110.968 179.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.483 HD22 HG23 ' A' ' 16' ' ' VAL . 6.9 t-20 -141.51 -167.56 2.45 Favored 'General case' 0 CA--C 1.543 0.7 0 O-C-N 120.715 -1.241 . . . . 0.0 111.469 163.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -124.51 145.7 31.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 C-N-CA 125.331 1.452 . . . . 0.0 109.488 167.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -51.94 142.3 15.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.69 1.196 . . . . 0.0 111.944 168.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.22 172.77 2.28 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 172.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.7 t -122.66 -25.07 4.76 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.098 1.359 . . . . 0.0 113.931 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 74.3 m -80.52 170.93 15.69 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.76 1.224 . . . . 0.0 111.993 172.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -117.54 110.96 18.6 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.726 1.21 . . . . 0.0 111.348 -177.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -106.39 161.98 14.09 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 125.87 1.668 . . . . 0.0 110.603 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -71.57 108.01 4.73 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 121.745 -0.597 . . . . 0.0 110.297 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -99.89 119.21 37.85 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.594 1.558 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 35.1 t -122.43 97.33 5.41 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.038 1.335 . . . . 0.0 110.459 -171.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -93.52 163.03 13.73 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.512 0.725 . . . . 0.0 111.067 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -152.82 107.85 3.22 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.496 -0.753 . . . . 0.0 111.875 163.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 31.1 m-80 -92.58 132.41 36.88 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.606 1.163 . . . . 0.0 111.215 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 23.0 t -56.72 148.07 4.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.509 1.523 . . . . 0.0 112.008 178.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 69.1 p -118.11 86.88 2.61 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.905 1.282 . . . . 0.0 111.684 179.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 32.2 p . . . . . 0 C--O 1.252 1.213 0 C-N-CA 125.833 1.653 . . . . 0.0 114.151 173.459 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 38.3 ptt85 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.749 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -71.73 -59.99 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 121.512 1.475 . . . . 0.0 112.027 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.4 m -140.89 175.78 9.34 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.357 1.863 . . . . 0.0 110.417 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -97.42 130.07 44.58 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.522 1.129 . . . . 0.0 110.516 -178.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -134.33 160.63 37.34 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.9 1.28 . . . . 0.0 112.205 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -109.57 153.14 24.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.536 1.934 . . . . 0.0 112.443 177.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.52 112.83 19.79 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 126.319 1.848 . . . . 0.0 111.727 -170.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.0 tptt -139.56 103.29 4.66 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.336 1.455 . . . . 0.0 112.275 -179.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -124.32 149.82 46.15 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.316 1.046 . . . . 0.0 111.656 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 7.1 t -148.79 174.81 11.81 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.603 1.561 . . . . 0.0 111.9 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.1 m -140.45 102.87 4.43 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.032 0.933 . . . . 0.0 110.997 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -168.66 170.22 9.6 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.916 1.286 . . . . 0.0 113.45 -172.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.426 ' H ' ' HD3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -60.07 170.85 1.11 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 127.911 2.484 . . . . 0.0 113.617 168.551 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 14.2 p90 -143.22 147.65 35.19 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.369 1.868 . . . . 0.0 111.609 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.0 t -106.1 141.91 36.68 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.063 0.945 . . . . 0.0 111.607 177.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.7 m -145.75 -179.4 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 126.175 1.79 . . . . 0.0 111.876 -175.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.3 m -127.17 118.55 24.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.144 0.978 . . . . 0.0 111.954 176.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.8 t -87.36 127.73 35.2 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.204 1.002 . . . . 0.0 111.794 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -135.58 114.72 12.3 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 125.057 1.343 . . . . 0.0 109.107 177.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 57.25 57.04 4.72 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.014 1.325 . . . . 0.0 112.535 -172.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.2 mp0 64.33 26.66 13.67 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 127.468 2.307 . . . . 0.0 114.719 170.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.41 135.08 6.56 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.961 1.304 . . . . 0.0 109.548 -177.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.56 107.85 2.57 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 123.714 2.943 . . . . 0.0 112.564 177.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.9 m -100.76 6.46 9.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 C-N-CA 125.495 1.518 . . . . 0.0 112.236 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -148.53 146.62 28.4 Favored 'General case' 0 N--CA 1.478 0.939 0 CA-C-N 120.797 1.635 . . . . 0.0 112.592 -175.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -103.0 131.7 49.79 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.732 1.213 . . . . 0.0 111.108 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -104.52 -52.96 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.146 0.978 . . . . 0.0 112.084 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 178.62 -172.58 44.93 Favored Glycine 0 CA--C 1.53 0.98 0 CA-C-N 119.098 0.863 . . . . 0.0 114.924 -173.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.8 t -123.69 124.01 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.724 1.61 . . . . 0.0 110.354 -173.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 65.78 3.62 16.41 Favored Glycine 0 CA--C 1.54 1.594 0 N-CA-C 115.864 1.105 . . . . 0.0 115.864 -178.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.5 m -169.88 163.75 9.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 128.62 2.768 . . . . 0.0 110.382 -176.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 74.9 m -103.98 105.86 16.18 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.574 1.55 . . . . 0.0 110.532 172.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.7 71.1 0.21 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 125.51 1.528 . . . . 0.0 113.166 -173.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.4 t -68.51 161.97 26.68 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.106 0.962 . . . . 0.0 112.395 173.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 164.49 -179.25 39.36 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.242 1.401 . . . . 0.0 113.805 -178.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -126.17 106.2 0.84 Allowed Glycine 0 CA--C 1.532 1.104 0 C-N-CA 126.107 1.813 . . . . 0.0 111.774 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.6 t -140.01 171.45 14.17 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.234 1.414 . . . . 0.0 112.138 179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -90.8 6.96 81.87 Favored Glycine 0 CA--C 1.537 1.438 0 C-N-CA 126.099 1.809 . . . . 0.0 115.37 -176.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 66.7 mt -60.0 136.05 24.01 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 125.797 1.639 . . . . 0.0 111.553 -174.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -142.22 18.42 2.08 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 126.575 1.95 . . . . 0.0 112.555 177.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 48.6 mt -70.89 -17.11 62.72 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.999 1.32 . . . . 0.0 114.443 -170.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -120.24 174.93 6.21 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.016 1.727 . . . . 0.0 112.586 167.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.6 m -57.03 -23.87 49.59 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.397 1.879 . . . . 0.0 113.435 178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.5 t 42.91 68.37 0.51 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 128.091 2.556 . . . . 0.0 112.648 179.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.502 ' H ' HD12 ' A' ' 45' ' ' LEU . 3.7 mp -51.39 106.09 0.13 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.873 2.069 . . . . 0.0 111.015 -176.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 37.2 t -155.44 -64.62 0.12 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.56 1.144 . . . . 0.0 111.382 -173.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.97 115.78 31.07 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.506 1.523 . . . . 0.0 110.619 178.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 74.89 10.35 83.69 Favored Glycine 0 CA--C 1.539 1.568 0 C-N-CA 124.175 0.893 . . . . 0.0 115.242 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 51.4 m -109.08 172.53 6.79 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 125.475 1.51 . . . . 0.0 111.34 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 p30 -155.66 168.52 26.91 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 123.429 1.585 . . . . 0.0 113.092 -177.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -57.18 -33.7 67.72 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.181 2.192 . . . . 0.0 113.787 174.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.96 -46.13 89.19 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.097 -1.002 . . . . 0.0 110.62 178.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.2 p -76.9 -26.53 54.24 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 173.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -52.81 -46.01 67.51 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.57 1.548 . . . . 0.0 112.46 175.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.7 mt-30 -56.96 -60.66 3.25 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.072 0.949 . . . . 0.0 110.791 175.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.99 -24.94 60.22 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 -179.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.37 -54.58 22.83 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.649 1.58 . . . . 0.0 114.047 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -146.9 20.22 1.27 Allowed 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.3 mt -126.72 150.19 32.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.063 1.345 . . . . 0.0 109.701 173.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 11.2 t -141.68 151.9 43.42 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 171.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -84.03 -3.71 58.22 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.604 1.562 . . . . 0.0 112.909 170.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.0 t -162.26 118.26 1.97 Allowed 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.255 1.822 . . . . 0.0 110.991 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 33.9 ttp-105 -69.0 100.31 1.2 Allowed 'General case' 0 N--CA 1.472 0.671 0 O-C-N 120.515 -1.365 . . . . 0.0 111.389 174.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -107.52 4.18 25.8 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.568 1.547 . . . . 0.0 113.171 173.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 77.5 t -75.45 138.72 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 125.327 1.451 . . . . 0.0 111.426 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -126.68 4.56 6.74 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.794 1.638 . . . . 0.0 113.155 175.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 9.6 m 54.16 35.78 23.3 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.98 2.112 . . . . 0.0 113.321 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -153.52 -27.38 0.14 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.742 2.417 . . . . 0.0 112.513 -172.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -115.06 3.88 14.54 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.146 1.778 . . . . 0.0 114.27 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.9 pt -63.57 -8.33 3.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.219 1.407 . . . . 0.0 113.617 174.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 27.9 ttt -54.1 -28.15 37.55 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.955 1.302 . . . . 0.0 112.752 162.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.6 t -92.98 -0.7 57.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.153 1.781 . . . . 0.0 114.215 178.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.8 p -114.76 -175.59 2.72 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.385 1.474 . . . . 0.0 111.4 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -64.15 -15.91 60.78 Favored 'General case' 0 CA--C 1.546 0.812 0 O-C-N 120.935 -1.103 . . . . 0.0 113.711 176.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -100.28 17.72 20.66 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.167 1.787 . . . . 0.0 114.24 -164.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -68.85 -7.64 36.31 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 128.984 2.914 . . . . 0.0 114.682 -173.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -63.28 2.26 0.4 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 128.179 2.592 . . . . 0.0 115.817 -171.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.2 t 56.79 27.92 13.57 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.263 1.825 . . . . 0.0 114.117 -176.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.95 154.93 17.68 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.131 1.372 . . . . 0.0 112.207 177.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -64.7 -33.97 77.21 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.746 1.388 . . . . 0.0 114.746 -170.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.9 ptmm? -161.37 160.03 29.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.905 1.682 . . . . 0.0 112.676 167.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -131.03 125.37 33.09 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.377 1.071 . . . . 0.0 109.766 163.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 49.3 m -87.64 95.2 9.97 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.546 1.138 . . . . 0.0 109.964 171.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -82.5 127.83 33.7 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.878 -0.514 . . . . 0.0 111.455 176.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 61.8 mt -97.93 114.92 36.6 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 125.015 1.326 . . . . 0.0 107.845 172.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -89.26 87.45 7.14 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.46 0.704 . . . . 0.0 110.203 172.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.2 m -144.94 165.63 27.6 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.739 2.015 . . . . 0.0 112.549 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 63.7 mtt180 -74.22 164.28 62.35 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 124.339 1.056 . . . . 0.0 110.761 161.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.28 -23.98 17.2 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.509 2.139 . . . . 0.0 114.147 174.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -59.21 -55.59 44.73 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 124.419 1.088 . . . . 0.0 113.466 -177.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -70.46 -1.51 9.18 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 123.107 2.538 . . . . 0.0 114.575 179.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 16.0 t -99.55 -54.24 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 C-N-CA 126.249 1.819 . . . . 0.0 109.398 176.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -45.33 81.22 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.25 -0.906 . . . . 0.0 112.912 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.85 -3.63 36.28 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 114.557 1.318 . . . . 0.0 114.557 -171.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 52.8 mt -53.93 -35.34 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 123.609 0.764 . . . . 0.0 110.665 171.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 21.0 p -111.39 158.43 19.08 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.245 1.418 . . . . 0.0 113.118 173.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -155.56 112.99 3.3 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 125.978 1.711 . . . . 0.0 110.402 175.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.09 2.95 90.57 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.666 1.127 . . . . 0.0 114.97 -179.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 50.6 mt -77.33 118.53 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.967 1.307 . . . . 0.0 111.063 -176.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.0 mt -111.15 -13.1 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 126.595 1.958 . . . . 0.0 111.046 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.2 1.96 6.74 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.389 2.276 . . . . 0.0 116.355 -168.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 6.7 t 52.66 68.47 0.82 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.594 1.558 . . . . 0.0 112.431 -169.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -158.06 149.36 21.22 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.361 1.864 . . . . 0.0 110.516 -176.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -140.4 -168.1 2.48 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.643 -1.286 . . . . 0.0 111.364 164.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.8 p -126.36 149.38 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 C-N-CA 125.636 1.575 . . . . 0.0 109.729 168.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.4 tp -53.47 142.39 22.28 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.75 1.22 . . . . 0.0 111.644 168.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.52 173.24 1.7 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 173.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.6 t -124.9 -23.38 4.29 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.755 1.222 . . . . 0.0 114.177 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.9 m -79.59 170.52 16.43 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.38 1.072 . . . . 0.0 111.498 169.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -124.73 104.94 8.93 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 124.139 0.976 . . . . 0.0 111.522 -173.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -101.65 163.11 12.43 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.058 2.143 . . . . 0.0 110.798 -171.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -75.6 105.89 6.87 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.597 -0.689 . . . . 0.0 110.669 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -96.81 119.47 35.34 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.834 1.253 . . . . 0.0 111.667 178.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 31.8 t -119.64 87.63 2.78 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 126.041 1.736 . . . . 0.0 110.001 -171.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.9 163.94 21.9 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-O 122.325 1.06 . . . . 0.0 111.318 168.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -154.99 124.45 6.41 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 125.67 1.588 . . . . 0.0 108.689 162.511 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -111.04 139.39 46.44 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.357 1.063 . . . . 0.0 109.909 -175.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 16.0 t -60.99 148.58 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 123.754 0.822 . . . . 0.0 111.89 178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.2 t -140.48 86.05 2.04 Favored 'General case' 0 N--CA 1.478 0.971 0 CA-C-O 122.694 1.235 . . . . 0.0 111.867 173.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.1 t . . . . . 0 C--O 1.255 1.389 0 C-N-CA 125.745 1.618 . . . . 0.0 111.993 174.664 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -75.26 -51.1 0.12 Allowed 'Trans proline' 0 C--N 1.358 1.054 0 C-N-CA 122.496 2.13 . . . . 0.0 113.165 -164.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 83.7 m -141.11 167.49 22.06 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 127.701 2.4 . . . . 0.0 109.204 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.543 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 10.3 mmpt? -93.43 143.86 25.88 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.533 0.733 . . . . 0.0 111.174 172.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -138.25 161.64 36.36 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.557 1.543 . . . . 0.0 111.473 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.8 mtpp -97.43 154.23 17.61 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 127.297 2.239 . . . . 0.0 110.863 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.2 tp -79.83 128.47 33.48 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.964 0.906 . . . . 0.0 111.062 175.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.9 tptt -148.66 97.08 2.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.519 1.528 . . . . 0.0 111.771 173.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -110.72 142.52 42.53 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.819 1.247 . . . . 0.0 110.931 175.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 38.7 m -153.42 172.69 16.71 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.971 1.708 . . . . 0.0 111.066 -176.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 m -145.44 101.57 3.6 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 120.969 -1.082 . . . . 0.0 110.885 178.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.28 175.12 8.51 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.034 1.333 . . . . 0.0 113.316 -176.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.12 170.7 3.44 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 128.215 2.606 . . . . 0.0 113.801 171.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -140.06 142.56 36.15 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.116 1.767 . . . . 0.0 111.802 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 23.6 t -101.62 141.82 33.91 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.855 0.862 . . . . 0.0 111.405 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.516 HG23 HD22 ' A' ' 104' ' ' ASN . 15.2 m -146.75 -178.95 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 126.32 1.848 . . . . 0.0 111.282 -175.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.2 m -125.68 117.92 24.53 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.436 1.094 . . . . 0.0 111.194 174.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -84.4 134.57 34.47 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.564 0.697 . . . . 0.0 111.336 172.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -138.75 114.62 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 125.421 1.489 . . . . 0.0 108.403 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 57.98 55.78 5.08 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.668 1.187 . . . . 0.0 112.504 -171.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.9 24.43 11.23 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 127.655 2.382 . . . . 0.0 115.189 169.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.16 133.41 6.14 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 124.914 1.285 . . . . 0.0 109.421 -176.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -76.04 103.39 1.73 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 123.71 2.94 . . . . 0.0 112.354 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 7.1 m -98.41 10.08 6.77 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 C-N-CA 125.178 1.391 . . . . 0.0 112.288 178.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.3 t60 -150.62 143.66 24.75 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 120.851 1.659 . . . . 0.0 112.295 -173.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -98.2 137.12 37.42 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.217 1.007 . . . . 0.0 111.29 174.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.7 t -110.86 -53.77 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.97 0.908 . . . . 0.0 111.754 178.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.38 -171.12 42.91 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-N 118.782 0.719 . . . . 0.0 114.227 -174.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.7 t -126.14 129.45 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 125.373 1.469 . . . . 0.0 109.799 -176.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.16 0.21 7.19 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 116.436 1.334 . . . . 0.0 116.436 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -168.58 164.27 12.37 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 127.577 2.351 . . . . 0.0 110.645 -174.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 87.5 m -110.35 113.61 26.41 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.994 1.718 . . . . 0.0 111.419 173.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.12 104.84 1.88 Allowed Glycine 0 CA--C 1.535 1.326 0 C-N-CA 124.941 1.258 . . . . 0.0 112.345 175.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.9 t -60.12 148.98 34.02 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.43 1.092 . . . . 0.0 113.129 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.18 -88.39 0.12 Allowed Glycine 0 CA--C 1.536 1.381 0 C-N-CA 125.972 1.749 . . . . 0.0 112.618 -175.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -178.58 163.67 31.7 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 126.402 1.953 . . . . 0.0 111.949 172.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 97.5 p -74.0 167.27 21.85 Favored 'General case' 0 N--CA 1.475 0.818 0 O-C-N 121.99 -0.712 . . . . 0.0 112.305 173.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -74.74 -17.14 80.04 Favored Glycine 0 CA--C 1.537 1.456 0 O-C-N 121.529 -0.732 . . . . 0.0 114.094 174.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 3.7 mp -82.21 135.24 25.33 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 C-N-CA 125.549 1.539 . . . . 0.0 110.261 177.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -135.46 14.13 3.47 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.558 1.543 . . . . 0.0 113.237 177.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 87.8 mt -64.71 -20.79 66.53 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.171 1.788 . . . . 0.0 113.93 -177.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -109.97 158.21 18.47 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.376 1.47 . . . . 0.0 111.594 168.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.7 m -71.38 -27.16 63.14 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.469 0.708 . . . . 0.0 112.2 175.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 7.3 t 57.89 16.24 3.53 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.447 1.899 . . . . 0.0 114.385 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.1 mp 56.27 97.36 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 129.313 3.045 . . . . 0.0 111.884 -171.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.2 t -138.4 -61.22 0.6 Allowed 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.251 1.02 . . . . 0.0 112.624 -170.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -116.49 123.04 46.47 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.464 1.506 . . . . 0.0 110.54 178.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.44 7.18 72.52 Favored Glycine 0 CA--C 1.539 1.567 0 C-N-CA 124.36 0.981 . . . . 0.0 115.287 -177.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 50.2 m -101.37 171.87 7.33 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.209 1.404 . . . . 0.0 111.554 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -154.44 167.51 29.78 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 123.107 1.432 . . . . 0.0 112.94 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.4 t-105 -59.44 -34.05 72.03 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.436 1.895 . . . . 0.0 113.715 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.09 -44.73 96.04 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 120.982 -1.073 . . . . 0.0 110.728 179.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.0 p -76.18 -28.02 57.14 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.05 1.34 . . . . 0.0 113.965 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -52.44 -45.19 65.89 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-N 120.65 1.568 . . . . 0.0 112.749 176.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.58 -62.81 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.447 1.099 . . . . 0.0 110.629 173.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.0 mmmt -60.55 -19.78 58.37 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 -178.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 mmtp -68.67 -51.15 44.96 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.176 1.79 . . . . 0.0 113.769 174.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 p80 -151.24 23.4 0.73 Allowed 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -174.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.9 mt -127.99 148.9 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 125.493 1.517 . . . . 0.0 109.367 179.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.6 t -146.74 156.95 43.55 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 175.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -92.74 2.7 56.6 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.227 1.811 . . . . 0.0 112.403 169.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 8.0 t -160.03 114.06 2.23 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.216 1.806 . . . . 0.0 111.089 172.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.6 ttp-105 -66.58 106.33 1.76 Allowed 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.675 -1.266 . . . . 0.0 110.643 173.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -116.05 4.16 13.68 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.353 1.461 . . . . 0.0 113.346 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.3 p -75.91 145.69 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 124.392 1.077 . . . . 0.0 112.978 -178.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -130.88 6.85 4.68 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 126.24 1.816 . . . . 0.0 112.943 173.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.4 m 50.78 47.7 24.08 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 127.589 2.355 . . . . 0.0 113.53 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -164.12 -28.23 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.651 2.38 . . . . 0.0 112.323 179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -103.65 0.44 30.7 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.183 1.393 . . . . 0.0 113.563 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.7 pt -62.81 -11.53 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.095 1.358 . . . . 0.0 113.706 177.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -54.67 -31.3 57.5 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 124.238 1.015 . . . . 0.0 112.899 165.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 70.1 m -82.39 1.71 35.95 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.219 1.408 . . . . 0.0 114.527 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.7 p -118.0 -176.12 2.98 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.895 1.678 . . . . 0.0 111.715 -177.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -64.86 -19.12 65.72 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -88.21 13.08 12.16 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.364 1.866 . . . . 0.0 114.208 -172.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -66.31 -9.74 35.95 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 127.032 2.133 . . . . 0.0 114.82 -172.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -61.67 -7.75 3.78 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 127.625 2.37 . . . . 0.0 115.554 -173.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.0 t 39.11 58.69 1.8 Allowed 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 126.793 2.037 . . . . 0.0 113.635 -168.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.403 ' HG3' ' H ' ' A' ' 79' ' ' LYS . 0.0 OUTLIER -68.91 160.98 29.72 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.136 1.374 . . . . 0.0 112.025 162.445 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -66.84 -31.27 71.77 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -170.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 6.8 ptmm? -160.12 156.23 26.42 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.402 1.481 . . . . 0.0 111.959 169.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -132.1 112.68 12.53 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.115 0.966 . . . . 0.0 111.032 174.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 58.8 m -83.43 96.71 8.64 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.442 0.697 . . . . 0.0 110.439 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -80.64 132.87 35.65 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 122.835 0.454 . . . . 0.0 111.233 173.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 78.1 mt -104.95 113.54 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 C-N-CA 125.196 1.398 . . . . 0.0 107.661 171.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -85.6 86.43 7.37 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 121.313 0.578 . . . . 0.0 109.614 167.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t -150.39 167.42 27.14 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.95 1.3 . . . . 0.0 112.518 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 65.4 mtp180 -79.85 160.68 68.53 Favored Pre-proline 0 N--CA 1.476 0.865 0 C-N-CA 126.059 1.744 . . . . 0.0 110.536 175.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -70.54 -22.84 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.076 1.851 . . . . 0.0 114.593 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -63.32 -57.14 21.7 Favored Pre-proline 0 N--CA 1.473 0.721 0 C-N-CA 124.214 1.006 . . . . 0.0 112.977 -178.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -68.04 -0.27 5.34 Favored 'Trans proline' 0 C--N 1.352 0.755 0 C-N-CA 123.212 2.608 . . . . 0.0 114.897 178.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.6 t -101.33 -54.9 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 C-N-CA 126.584 1.953 . . . . 0.0 109.736 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.47 -45.78 78.55 Favored 'General case' 0 N--CA 1.474 0.725 0 O-C-N 121.288 -0.883 . . . . 0.0 112.924 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.53 -2.96 31.46 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 63.4 mt -53.41 -35.87 25.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 123.618 0.767 . . . . 0.0 110.486 169.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.1 p -109.56 158.93 17.52 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.415 1.086 . . . . 0.0 113.222 173.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -155.57 103.27 2.28 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.114 1.766 . . . . 0.0 109.899 179.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.93 4.57 84.51 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.389 0.995 . . . . 0.0 114.807 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.2 mt -74.93 114.76 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 118.599 1.2 . . . . 0.0 111.113 -178.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.93 -15.13 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 126.717 2.007 . . . . 0.0 110.68 171.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.54 23.92 0.21 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 128.666 2.787 . . . . 0.0 115.45 -171.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 74.2 p 41.28 64.63 0.97 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 126.334 1.854 . . . . 0.0 114.069 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -154.6 158.7 40.13 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.709 1.603 . . . . 0.0 111.215 -177.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.516 HD22 HG23 ' A' ' 16' ' ' VAL . 5.7 t-20 -142.34 -170.63 3.22 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 120.738 -1.226 . . . . 0.0 111.796 160.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -124.09 139.58 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 C-N-CA 125.541 1.537 . . . . 0.0 108.705 171.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.5 tp -49.85 140.17 12.22 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.551 1.14 . . . . 0.0 111.906 170.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.4 172.28 1.59 Allowed 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 173.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.1 t -119.55 -29.65 5.04 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.969 1.308 . . . . 0.0 113.366 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 31.7 m -77.14 169.58 18.08 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.305 1.442 . . . . 0.0 112.171 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -117.83 107.39 14.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.442 1.097 . . . . 0.0 111.22 -177.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -100.55 161.81 13.35 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.729 1.612 . . . . 0.0 110.595 -175.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -72.1 106.38 4.32 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.285 0.564 . . . . 0.0 110.294 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -97.63 122.19 40.42 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.498 1.519 . . . . 0.0 110.889 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 37.8 t -126.14 93.63 3.87 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.512 1.525 . . . . 0.0 109.312 -173.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -93.69 163.09 13.68 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 122.286 1.041 . . . . 0.0 111.057 172.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -148.51 134.8 19.44 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.54 1.536 . . . . 0.0 108.429 164.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 21.3 m-80 -118.27 127.94 54.2 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.512 1.125 . . . . 0.0 110.391 -175.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.1 t -56.27 144.85 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.657 0.783 . . . . 0.0 111.874 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 7.1 t -135.31 103.51 5.53 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.919 1.287 . . . . 0.0 111.197 173.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.255 1.351 0 C-N-CA 126.238 1.815 . . . . 0.0 112.394 179.662 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 118.628 -0.701 . . . . 0.0 111.592 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -68.08 -43.57 4.68 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.205 1.937 . . . . 0.0 112.239 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.79 168.82 18.83 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.466 1.906 . . . . 0.0 110.207 -179.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -88.79 127.96 35.63 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.653 1.181 . . . . 0.0 111.161 -177.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -138.79 155.32 48.27 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 124.422 1.089 . . . . 0.0 113.336 179.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -93.77 155.41 17.24 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 127.254 2.222 . . . . 0.0 111.725 179.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -83.39 114.5 21.49 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.678 1.591 . . . . 0.0 111.675 176.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -139.34 114.87 9.89 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.582 1.553 . . . . 0.0 111.338 176.009 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -132.74 147.39 52.32 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.742 1.617 . . . . 0.0 111.179 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.8 m -156.86 171.86 19.67 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.535 1.934 . . . . 0.0 111.683 -177.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.2 m -142.38 105.02 4.51 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.548 -0.72 . . . . 0.0 111.103 175.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.68 173.98 5.16 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.051 1.34 . . . . 0.0 113.397 -170.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.9 173.43 0.77 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.596 2.358 . . . . 0.0 114.273 168.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 13.9 p90 -144.14 145.34 32.05 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 127.022 2.129 . . . . 0.0 111.441 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.4 t -107.17 143.94 34.62 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.915 0.864 . . . . 0.0 112.441 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.533 HG23 HD22 ' A' ' 104' ' ' ASN . 16.0 m -149.22 -179.39 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 126.621 1.968 . . . . 0.0 111.62 -171.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.7 m -126.36 120.53 30.09 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.148 0.979 . . . . 0.0 111.336 174.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.31 132.69 34.3 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.961 0.905 . . . . 0.0 111.277 174.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -136.85 121.72 18.76 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.229 1.412 . . . . 0.0 108.53 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 55.43 53.76 9.41 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.614 1.165 . . . . 0.0 112.46 -171.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 64.91 26.45 12.82 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.379 2.271 . . . . 0.0 115.04 170.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -156.54 132.78 6.0 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.806 1.243 . . . . 0.0 109.587 -176.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -76.06 105.37 2.07 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.735 2.957 . . . . 0.0 112.283 179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.42 HG12 ' N ' ' A' ' 51' ' ' TRP . 7.3 m -104.61 15.83 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 125.688 1.595 . . . . 0.0 112.397 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.417 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 16.5 t-80 -154.96 145.74 22.43 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-N 119.696 1.135 . . . . 0.0 112.114 -176.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -102.15 137.53 40.29 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.534 1.134 . . . . 0.0 111.356 175.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 43.9 t -111.87 -52.62 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.926 0.89 . . . . 0.0 112.539 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.23 -172.43 43.45 Favored Glycine 0 CA--C 1.53 0.978 0 CA-C-N 119.194 0.906 . . . . 0.0 115.198 -171.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 40.6 t -128.19 126.82 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.976 1.71 . . . . 0.0 110.786 -170.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.51 -13.12 5.2 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.746 1.165 . . . . 0.0 115.753 176.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 70.6 m -163.35 169.61 18.78 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 130.926 3.691 . . . . 0.0 108.469 -164.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 t -128.33 128.45 44.59 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.045 0.938 . . . . 0.0 111.383 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -109.52 172.98 16.54 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 125.366 1.46 . . . . 0.0 114.305 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.0 t -150.06 178.14 9.22 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.818 1.647 . . . . 0.0 111.768 177.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -169.73 179.85 41.89 Favored Glycine 0 CA--C 1.537 1.415 0 C-N-CA 125.947 1.736 . . . . 0.0 113.325 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -148.87 46.87 0.66 Allowed Glycine 0 CA--C 1.534 1.237 0 C-N-CA 124.913 1.244 . . . . 0.0 113.932 -174.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.3 m -132.65 163.6 28.58 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.597 1.559 . . . . 0.0 112.303 -178.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -83.19 14.42 39.36 Favored Glycine 0 CA--C 1.539 1.594 0 C-N-CA 125.55 1.547 . . . . 0.0 115.733 -177.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 79.4 mt -62.72 141.36 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.309 1.844 . . . . 0.0 111.099 -175.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -140.01 15.95 2.46 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.586 1.554 . . . . 0.0 113.116 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.23 -18.78 63.92 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 120.9 -1.125 . . . . 0.0 113.606 -177.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -65.32 167.85 7.87 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.021 0.928 . . . . 0.0 113.137 168.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.0 m -62.48 -30.98 71.65 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.811 -1.18 . . . . 0.0 112.913 176.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 4.5 t 44.82 58.59 3.87 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.997 2.119 . . . . 0.0 113.67 -177.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.6 mp -57.56 -18.49 19.74 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 t -57.03 -26.53 60.47 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 126.358 1.863 . . . . 0.0 113.876 172.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -132.13 108.95 9.63 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.396 1.478 . . . . 0.0 111.567 177.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.89 4.36 60.28 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.815 1.197 . . . . 0.0 115.206 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -136.99 -167.49 2.1 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.085 1.354 . . . . 0.0 112.472 173.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -153.99 170.51 20.91 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.581 1.952 . . . . 0.0 110.307 -177.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.42 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.7 t-105 -56.65 -37.08 70.27 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.477 2.311 . . . . 0.0 112.698 170.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -42.63 91.24 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.248 1.019 . . . . 0.0 111.357 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 4.3 p -85.4 -27.14 25.99 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.119 1.368 . . . . 0.0 113.941 174.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -51.48 -41.68 61.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.283 1.433 . . . . 0.0 112.682 174.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -57.56 -64.34 0.93 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.026 0.931 . . . . 0.0 110.614 172.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -59.87 -21.0 60.41 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -177.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -65.77 -51.44 59.1 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 126.307 1.843 . . . . 0.0 112.572 175.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -150.46 22.21 0.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 115.583 1.698 . . . . 0.0 115.583 -174.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -128.91 144.67 37.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 120.196 -1.565 . . . . 0.0 109.517 178.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -143.06 153.46 42.96 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -84.38 -0.45 52.72 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.733 1.613 . . . . 0.0 112.714 169.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.7 t -164.09 112.18 1.15 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.259 1.824 . . . . 0.0 111.405 177.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.6 ttp85 -67.99 104.53 1.76 Allowed 'General case' 0 N--CA 1.475 0.795 0 O-C-N 120.429 -1.42 . . . . 0.0 110.583 172.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -116.84 3.31 12.91 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 125.457 1.503 . . . . 0.0 113.193 176.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.444 HG22 ' H ' ' A' ' 67' ' ' CYS . 10.5 p -73.8 147.4 9.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 125.042 1.337 . . . . 0.0 112.573 -179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -134.6 9.18 3.64 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.92 1.688 . . . . 0.0 112.531 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.444 ' H ' HG22 ' A' ' 65' ' ' VAL . 35.2 m 51.47 38.68 22.7 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 127.444 2.298 . . . . 0.0 113.193 -175.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -145.33 -36.17 0.3 Allowed 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 128.386 2.674 . . . . 0.0 112.655 -174.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 13.0 p30 -100.08 -4.33 30.05 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.666 1.586 . . . . 0.0 113.633 -179.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.0 pt -60.27 -14.59 8.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 124.546 1.138 . . . . 0.0 113.637 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 25.8 ttt -53.91 -26.63 26.1 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.938 1.695 . . . . 0.0 113.568 168.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.0 t -103.49 1.98 33.05 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.95 1.7 . . . . 0.0 113.849 179.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 24.1 p -103.31 -174.2 2.49 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 125.494 1.518 . . . . 0.0 111.552 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -63.25 -20.62 65.61 Favored 'General case' 0 CA--C 1.546 0.817 0 O-C-N 121.129 -0.982 . . . . 0.0 113.582 169.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -94.38 12.32 27.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.77 1.628 . . . . 0.0 114.059 -166.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -65.2 -5.11 6.09 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.516 2.726 . . . . 0.0 114.914 -176.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.5 t60 -61.27 -4.8 1.31 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 126.976 2.11 . . . . 0.0 115.069 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.4 t 56.55 33.76 23.21 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 126.327 1.851 . . . . 0.0 113.77 -177.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 160.08 14.13 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.377 1.471 . . . . 0.0 112.351 176.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -67.04 -36.45 82.1 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.562 1.145 . . . . 0.0 113.754 -172.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -159.66 159.62 33.24 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.049 1.34 . . . . 0.0 111.841 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 19.9 t30 -140.52 127.98 21.35 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.383 0.673 . . . . 0.0 110.433 167.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 50.0 m -92.41 91.95 7.88 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.151 0.98 . . . . 0.0 109.685 176.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -75.63 125.29 28.74 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 123.657 0.783 . . . . 0.0 111.043 177.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 91.5 mt -103.41 115.8 46.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 125.39 1.476 . . . . 0.0 107.661 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -89.49 86.17 6.7 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.67 0.748 . . . . 0.0 109.749 169.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 79.0 p -146.46 166.59 25.94 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.092 1.757 . . . . 0.0 111.959 172.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 29.1 mmm-85 -78.71 161.09 70.52 Favored Pre-proline 0 N--CA 1.476 0.86 0 C-N-CA 125.092 1.357 . . . . 0.0 110.422 172.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -69.93 -21.23 32.99 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 122.102 1.868 . . . . 0.0 114.436 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -63.12 -57.0 23.05 Favored Pre-proline 0 CA--C 1.544 0.743 0 CA-C-O 117.983 -1.008 . . . . 0.0 112.575 -178.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.22 -0.25 5.44 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.25 2.633 . . . . 0.0 115.168 177.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.6 t -100.96 -55.24 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 C-N-CA 126.07 1.748 . . . . 0.0 109.833 174.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.09 -44.4 80.11 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.159 -0.963 . . . . 0.0 112.989 -179.204 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.47 -2.96 31.27 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 114.495 1.294 . . . . 0.0 114.495 -173.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 65.4 mt -53.36 -35.77 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.668 0.787 . . . . 0.0 110.483 169.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 30.3 p -109.67 158.54 17.97 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.414 1.086 . . . . 0.0 113.308 174.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -153.26 107.72 3.12 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.318 1.847 . . . . 0.0 109.833 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 81.6 5.23 90.06 Favored Glycine 0 CA--C 1.535 1.342 0 C-N-CA 124.337 0.97 . . . . 0.0 114.786 179.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.4 mt -75.73 114.74 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.564 1.146 . . . . 0.0 111.028 -177.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.1 mt -109.58 -12.62 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 126.685 1.994 . . . . 0.0 110.861 172.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.99 5.45 3.31 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.665 2.386 . . . . 0.0 116.143 -171.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 14.4 t 51.39 65.73 1.4 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.58 1.552 . . . . 0.0 112.904 -172.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -154.44 157.93 39.2 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 126.214 1.806 . . . . 0.0 111.076 177.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.533 HD22 HG23 ' A' ' 16' ' ' VAL . 6.2 t-20 -142.02 -169.98 3.05 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 120.783 -1.198 . . . . 0.0 111.86 163.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.5 t -124.36 141.87 43.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 C-N-CA 125.681 1.592 . . . . 0.0 108.7 170.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -51.02 142.31 12.32 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.811 1.245 . . . . 0.0 111.742 169.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.54 172.24 2.17 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 174.625 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.0 t -120.26 -26.28 5.5 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.199 1.399 . . . . 0.0 113.519 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 34.0 m -81.06 171.01 15.48 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.492 1.517 . . . . 0.0 112.006 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -116.54 110.56 18.73 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.504 1.122 . . . . 0.0 111.34 -179.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -106.38 158.31 16.98 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.818 1.647 . . . . 0.0 109.893 -177.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -70.45 110.75 5.53 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.634 -0.666 . . . . 0.0 110.719 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -101.03 125.51 47.65 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.635 1.574 . . . . 0.0 111.766 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 39.0 t -130.8 91.7 3.11 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 125.386 1.475 . . . . 0.0 110.796 -172.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -85.5 163.32 18.5 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.959 0.885 . . . . 0.0 111.87 170.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -146.05 140.59 26.9 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 158.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -128.82 129.35 45.49 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.983 0.913 . . . . 0.0 109.907 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.83 146.63 8.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.87 0.868 . . . . 0.0 112.687 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.0 t -136.02 77.77 1.68 Allowed 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 122.926 1.346 . . . . 0.0 111.863 174.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 75.7 m . . . . . 0 C--O 1.252 1.221 0 C-N-CA 127.44 2.296 . . . . 0.0 112.697 177.708 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.9 ptp180 . . . . . 0 N--CA 1.493 1.675 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -75.27 -48.08 0.17 Allowed 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 121.564 1.509 . . . . 0.0 113.642 -171.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 86.9 m -128.53 174.84 9.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 127.224 2.21 . . . . 0.0 109.482 169.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.3 mmmt -105.48 145.19 31.21 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.173 1.389 . . . . 0.0 108.625 171.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.78 158.51 43.85 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.942 1.297 . . . . 0.0 110.923 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.2 pttt -100.11 159.42 15.12 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.922 1.289 . . . . 0.0 113.22 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.57 105.7 17.03 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.654 1.582 . . . . 0.0 111.362 -169.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -131.96 112.47 12.43 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.638 1.575 . . . . 0.0 111.051 178.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -131.44 141.91 49.91 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 125.916 1.687 . . . . 0.0 111.016 175.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 67.4 m -146.74 168.06 22.31 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.807 1.643 . . . . 0.0 111.348 -175.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.3 m -141.15 103.65 4.48 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 121.572 -0.705 . . . . 0.0 111.296 178.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -171.0 173.52 5.06 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.99 1.316 . . . . 0.0 113.068 -169.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.25 171.77 0.96 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 127.489 2.316 . . . . 0.0 113.841 167.239 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -142.64 147.7 36.21 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.783 2.033 . . . . 0.0 111.197 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 21.3 t -107.58 141.34 39.19 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.896 0.879 . . . . 0.0 111.341 176.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.488 HG23 HD22 ' A' ' 104' ' ' ASN . 15.8 m -146.86 -178.92 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 C-N-CA 126.35 1.86 . . . . 0.0 111.25 -175.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.422 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 1.7 m -126.77 119.24 26.39 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 121.257 -0.902 . . . . 0.0 111.45 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -88.2 132.4 34.37 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.96 0.904 . . . . 0.0 111.668 175.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -140.13 115.67 10.06 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.038 1.335 . . . . 0.0 108.796 176.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 58.68 56.37 4.24 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.273 1.429 . . . . 0.0 112.397 -169.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 64.54 24.3 13.04 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.737 2.415 . . . . 0.0 115.06 169.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.86 132.71 5.43 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 124.827 1.251 . . . . 0.0 109.444 -173.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -76.28 106.45 2.26 Favored 'Trans proline' 0 N--CA 1.457 -0.665 0 C-N-CA 123.794 2.996 . . . . 0.0 112.189 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.44 HG12 ' N ' ' A' ' 51' ' ' TRP . 5.9 m -101.38 14.33 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 125.329 1.452 . . . . 0.0 111.85 -178.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.422 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 20.8 t-80 -158.95 141.8 14.39 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 120.037 1.29 . . . . 0.0 112.651 -167.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -92.67 146.95 23.27 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.613 0.765 . . . . 0.0 112.096 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.9 t -120.1 -55.7 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 124.146 0.978 . . . . 0.0 112.436 172.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.39 -173.36 42.83 Favored Glycine 0 CA--C 1.53 1.018 0 CA-C-N 119.297 0.953 . . . . 0.0 115.388 -170.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 38.4 t -127.0 122.99 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.97 1.708 . . . . 0.0 110.235 -172.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.54 -0.05 7.44 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 115.959 1.143 . . . . 0.0 115.959 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.1 m -170.29 165.66 8.86 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 129.28 3.032 . . . . 0.0 110.289 -174.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.9 m -106.35 114.32 28.37 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.742 1.617 . . . . 0.0 110.839 174.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.25 84.09 0.69 Allowed Glycine 0 CA--C 1.533 1.163 0 C-N-CA 125.585 1.564 . . . . 0.0 113.02 -175.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 6.1 t -69.86 168.54 14.95 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.292 1.037 . . . . 0.0 112.938 174.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 131.89 -178.2 18.09 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 126.268 1.89 . . . . 0.0 114.352 177.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 92.75 163.47 37.47 Favored Glycine 0 CA--C 1.538 1.499 0 C-N-CA 126.091 1.805 . . . . 0.0 114.431 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.6 t -155.11 95.81 1.77 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.117 1.367 . . . . 0.0 111.828 -174.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.5 8.62 71.85 Favored Glycine 0 CA--C 1.541 1.671 0 C-N-CA 124.464 1.03 . . . . 0.0 115.499 178.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 65.6 mt -75.03 145.42 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 126.227 1.811 . . . . 0.0 110.209 -177.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 25.4 p90 -135.66 15.06 3.4 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.55 1.54 . . . . 0.0 113.803 -176.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 90.0 mt -61.31 -32.97 72.84 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.467 1.507 . . . . 0.0 113.197 177.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.93 164.12 22.92 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.086 1.355 . . . . 0.0 113.141 172.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.3 m -63.77 -29.59 70.78 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.125 -0.984 . . . . 0.0 113.141 177.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 8.4 t 51.12 52.16 15.51 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.976 1.71 . . . . 0.0 113.462 179.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.1 mp -54.46 -20.11 6.97 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.985 1.314 . . . . 0.0 114.277 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.1 m -56.33 -20.75 20.42 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.556 1.942 . . . . 0.0 114.82 171.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.27 110.64 9.05 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.49 1.516 . . . . 0.0 110.927 175.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.79 1.98 63.2 Favored Glycine 0 CA--C 1.538 1.487 0 C-N-CA 124.961 1.267 . . . . 0.0 115.146 -178.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -139.15 -170.91 2.99 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.971 1.708 . . . . 0.0 110.891 175.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -152.69 172.42 16.68 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.025 1.73 . . . . 0.0 110.395 -177.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.44 ' N ' HG12 ' A' ' 24' ' ' VAL . 2.5 t-105 -53.74 -36.56 62.44 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 127.079 2.152 . . . . 0.0 112.274 168.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.32 -45.44 93.39 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.809 0.844 . . . . 0.0 111.015 177.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.9 p -72.01 -35.61 69.47 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -54.14 -44.11 71.13 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.463 1.505 . . . . 0.0 113.065 -177.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -54.14 -62.04 1.91 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.367 1.067 . . . . 0.0 110.725 173.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.403 ' H ' ' HD2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -61.65 -20.29 63.24 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -179.215 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.6 tptt -68.62 -54.78 14.35 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.785 1.634 . . . . 0.0 113.437 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -133.17 6.7 3.9 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -172.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.12 147.49 30.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 O-C-N 120.387 -1.446 . . . . 0.0 110.107 -173.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -142.49 153.26 43.49 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 176.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -81.55 -5.54 58.1 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.857 1.663 . . . . 0.0 112.882 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.1 t -165.14 121.22 1.41 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.633 1.973 . . . . 0.0 110.569 178.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.0 ttp-105 -66.44 104.52 1.26 Allowed 'General case' 0 N--CA 1.473 0.711 0 O-C-N 120.488 -1.383 . . . . 0.0 110.8 174.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -113.97 2.79 15.13 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.219 1.408 . . . . 0.0 113.455 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.454 HG22 ' H ' ' A' ' 67' ' ' CYS . 9.7 p -74.7 146.03 10.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.115 0.966 . . . . 0.0 112.235 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -130.4 7.36 4.93 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.891 1.676 . . . . 0.0 112.742 171.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.454 ' H ' HG22 ' A' ' 65' ' ' VAL . 18.6 m 52.26 42.99 31.12 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.602 2.361 . . . . 0.0 113.023 -177.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -155.77 -25.61 0.11 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 127.405 2.282 . . . . 0.0 113.349 -178.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -106.32 -4.21 20.29 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.058 1.343 . . . . 0.0 113.94 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.8 pt -60.33 -12.29 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.006 1.322 . . . . 0.0 113.885 -179.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.36 -24.23 28.36 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 167.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 69.8 m -91.29 -5.37 54.78 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.363 1.465 . . . . 0.0 114.356 174.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.4 p -103.43 -176.7 3.16 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.497 1.519 . . . . 0.0 111.927 -176.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -64.98 -19.49 66.01 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 121.173 -0.954 . . . . 0.0 113.465 171.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -93.64 20.12 7.82 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 127.008 2.123 . . . . 0.0 113.471 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.8 p90 -63.94 -9.26 14.52 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.022 2.129 . . . . 0.0 114.61 -176.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -63.55 -2.33 1.59 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.853 2.461 . . . . 0.0 115.342 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 57.82 21.03 7.08 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.149 1.78 . . . . 0.0 114.755 178.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.67 157.81 11.21 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.79 2.036 . . . . 0.0 114.485 -173.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -58.02 -39.46 78.4 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.081 1.752 . . . . 0.0 114.694 -168.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 4.3 ptmm? -159.4 157.49 30.38 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.161 1.384 . . . . 0.0 112.525 167.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 61.9 t30 -135.1 128.67 32.63 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.339 1.056 . . . . 0.0 110.532 167.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 32.1 m -88.77 99.12 12.11 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.989 0.916 . . . . 0.0 109.659 176.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -82.5 135.05 35.2 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.321 -0.862 . . . . 0.0 112.337 174.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 66.4 mt -107.73 111.17 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 C-N-CA 125.702 1.601 . . . . 0.0 107.676 174.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -85.98 86.67 7.35 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.56 -0.713 . . . . 0.0 109.845 169.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 t -152.32 175.0 13.13 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.244 1.018 . . . . 0.0 113.338 168.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 79.3 mtm180 -74.61 162.68 72.62 Favored Pre-proline 0 N--CA 1.472 0.668 0 C-N-CA 128.03 2.532 . . . . 0.0 110.678 174.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -72.43 -24.94 18.7 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 122.267 1.978 . . . . 0.0 114.02 176.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -62.82 -55.53 37.36 Favored Pre-proline 0 CA--C 1.543 0.701 0 C-N-CA 124.397 1.079 . . . . 0.0 113.07 -176.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -69.26 -1.26 7.75 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 122.829 2.353 . . . . 0.0 114.724 178.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 20.7 t -99.89 -54.61 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 126.152 1.781 . . . . 0.0 109.6 174.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.403 ' HE3' ' NE1' ' A' ' 51' ' ' TRP . 0.0 OUTLIER -66.54 -46.06 77.39 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.217 -0.927 . . . . 0.0 112.983 -179.184 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.56 -2.99 31.69 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -171.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.0 mt -53.25 -35.89 24.8 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 123.793 0.837 . . . . 0.0 110.599 169.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.9 p -110.34 158.97 17.86 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.667 1.187 . . . . 0.0 113.204 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -156.41 104.34 2.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 126.18 1.792 . . . . 0.0 109.932 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 85.92 3.15 85.81 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 124.465 1.031 . . . . 0.0 114.949 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.0 mt -74.82 115.48 16.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-N 118.542 1.171 . . . . 0.0 111.238 -177.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.3 mt -108.81 -13.1 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 126.383 1.873 . . . . 0.0 110.962 171.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.06 4.1 3.82 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.517 2.327 . . . . 0.0 116.262 -170.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.4 t 53.14 64.4 1.87 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.619 1.568 . . . . 0.0 112.804 -173.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -155.49 158.23 38.19 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.399 1.88 . . . . 0.0 111.091 178.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.488 HD22 HG23 ' A' ' 16' ' ' VAL . 6.9 t-20 -141.52 -167.97 2.54 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.659 -1.275 . . . . 0.0 111.721 164.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.59 146.18 31.74 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.39 0 C-N-CA 125.579 1.552 . . . . 0.0 109.603 167.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 31.6 tp -51.41 142.72 13.06 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.891 1.276 . . . . 0.0 112.002 168.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.73 173.09 1.86 Allowed 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 172.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 13.0 t -122.99 -23.89 4.88 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.092 1.357 . . . . 0.0 113.943 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 73.8 m -81.42 171.07 15.19 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.778 1.231 . . . . 0.0 111.947 173.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.76 106.65 13.26 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.778 1.231 . . . . 0.0 111.676 -176.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -101.28 162.73 12.69 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 126.036 1.735 . . . . 0.0 110.877 -175.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -73.3 105.64 4.79 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.694 -0.629 . . . . 0.0 110.382 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.96 122.63 38.98 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.068 1.347 . . . . 0.0 111.466 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 32.8 t -124.72 91.42 3.44 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.997 1.319 . . . . 0.0 110.726 -173.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -83.98 161.8 20.64 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 123.601 0.76 . . . . 0.0 111.693 171.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -151.76 109.78 3.7 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.115 0.966 . . . . 0.0 110.669 163.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -96.53 130.91 43.6 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.515 1.126 . . . . 0.0 110.828 -179.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.4 t -57.74 150.38 4.15 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 C-N-CA 125.321 1.448 . . . . 0.0 112.137 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 68.1 p -123.97 101.19 7.11 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.622 1.569 . . . . 0.0 111.453 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 55.2 m . . . . . 0 C--O 1.253 1.26 0 C-N-CA 128.078 2.551 . . . . 0.0 114.512 178.719 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.409 ' HA ' ' O ' ' A' ' 68' ' ' ASP . 91.5 mtt180 . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.61 -42.17 0.29 Allowed 'Trans proline' 0 C--N 1.356 0.939 0 C-N-CA 122.138 1.892 . . . . 0.0 113.488 -166.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.28 176.82 9.26 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 127.59 2.356 . . . . 0.0 109.6 -176.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.486 ' HA ' ' HE2' ' A' ' 4' ' ' LYS . 11.4 mmpt? -115.28 131.98 56.76 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.982 1.313 . . . . 0.0 110.702 175.258 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -136.2 160.67 37.99 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.529 1.531 . . . . 0.0 112.151 -176.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.0 mtpt -92.2 155.83 17.73 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 126.631 1.972 . . . . 0.0 112.145 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.42 107.71 18.17 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.652 1.581 . . . . 0.0 111.395 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.1 tptt -136.56 114.73 11.57 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.686 1.595 . . . . 0.0 111.069 178.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -133.34 132.09 40.88 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.989 1.716 . . . . 0.0 110.609 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 66.1 m -144.87 178.48 7.98 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 126.523 1.929 . . . . 0.0 111.595 -172.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 m -147.01 102.11 3.48 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.588 -1.32 . . . . 0.0 110.871 178.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -163.35 173.7 12.91 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.47 1.108 . . . . 0.0 113.652 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 168.31 5.19 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 128.133 2.573 . . . . 0.0 113.433 172.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.3 p90 -139.77 140.37 36.68 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.707 1.603 . . . . 0.0 111.868 -177.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.6 t -98.72 143.11 29.44 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 122.204 1.002 . . . . 0.0 111.487 174.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.486 HG23 HD22 ' A' ' 104' ' ' ASN . 16.5 m -147.22 -178.6 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 126.565 1.946 . . . . 0.0 111.193 -176.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.444 ' HB ' ' HB3' ' A' ' 25' ' ' HIS . 3.2 m -127.35 119.53 26.45 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.333 -0.854 . . . . 0.0 111.307 174.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.3 m -86.67 133.59 33.68 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.552 0.741 . . . . 0.0 111.248 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -138.73 114.33 9.8 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 125.337 1.455 . . . . 0.0 108.472 175.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 58.27 56.44 4.48 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.0 1.32 . . . . 0.0 112.489 -170.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 65.01 25.02 12.65 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 127.492 2.317 . . . . 0.0 115.091 169.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.39 132.57 5.55 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.921 1.288 . . . . 0.0 109.553 -175.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -76.26 105.52 2.09 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 123.812 3.008 . . . . 0.0 112.147 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.405 HG12 ' N ' ' A' ' 51' ' ' TRP . 8.5 m -101.02 15.14 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 125.106 1.363 . . . . 0.0 111.956 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.444 ' HB3' ' HB ' ' A' ' 17' ' ' THR . 24.7 t-80 -157.47 139.82 14.6 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 119.877 1.217 . . . . 0.0 112.741 -169.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -96.75 140.58 31.12 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.721 0.808 . . . . 0.0 111.306 173.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 92.1 t -109.8 -58.06 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.073 0.949 . . . . 0.0 111.598 175.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.08 -173.45 45.6 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 118.648 0.658 . . . . 0.0 113.191 -174.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.4 p -115.46 138.76 44.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.295 1.038 . . . . 0.0 110.981 178.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 60.46 4.69 4.1 Favored Glycine 0 CA--C 1.544 1.895 0 N-CA-C 116.992 1.557 . . . . 0.0 116.992 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -167.41 158.93 11.99 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.213 2.205 . . . . 0.0 110.749 -174.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 92.2 m -110.93 101.62 10.18 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.004 1.721 . . . . 0.0 111.042 172.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.07 159.13 50.29 Favored Glycine 0 CA--C 1.538 1.505 0 C-N-CA 123.333 0.492 . . . . 0.0 112.732 171.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 10.0 t -151.61 173.46 14.62 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.288 1.435 . . . . 0.0 111.772 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -157.41 173.59 34.87 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.739 1.638 . . . . 0.0 113.371 175.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -125.09 20.79 6.63 Favored Glycine 0 CA--C 1.536 1.347 0 C-N-CA 125.912 1.72 . . . . 0.0 114.601 -175.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 47.5 m -128.17 162.4 27.04 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.908 1.683 . . . . 0.0 112.5 -172.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.1 26.89 2.07 Favored Glycine 0 CA--C 1.539 1.566 0 C-N-CA 126.123 1.821 . . . . 0.0 115.961 -175.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 70.3 mt -65.81 138.84 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 126.042 1.737 . . . . 0.0 110.496 -177.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -145.04 18.94 1.6 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.988 1.315 . . . . 0.0 113.758 -174.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -67.02 -25.26 66.19 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 120.534 -1.353 . . . . 0.0 113.75 -176.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -64.77 167.99 6.77 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.457 1.903 . . . . 0.0 113.58 170.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.4 m -60.0 -33.09 71.52 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 120.986 -1.071 . . . . 0.0 112.88 175.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 5.0 t 44.19 63.44 1.63 Allowed 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.027 2.131 . . . . 0.0 113.531 -176.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.9 mp -57.44 -15.66 7.38 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.495 1.118 . . . . 0.0 114.006 178.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.7 m -57.29 -23.14 46.55 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 126.258 1.823 . . . . 0.0 114.454 170.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -136.68 107.66 6.7 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.403 1.481 . . . . 0.0 111.185 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.87 -1.8 55.39 Favored Glycine 0 CA--C 1.538 1.512 0 C-N-CA 125.196 1.379 . . . . 0.0 115.069 -178.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.8 m -137.14 -167.6 2.13 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.444 1.498 . . . . 0.0 111.106 174.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -155.87 172.94 17.5 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.97 1.708 . . . . 0.0 109.421 -177.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.405 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.1 t-105 -55.31 -37.74 67.76 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 126.51 1.924 . . . . 0.0 112.139 170.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.31 -37.6 78.17 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.775 1.23 . . . . 0.0 112.187 -179.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 21.9 p -92.81 -25.2 18.24 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.778 1.231 . . . . 0.0 113.587 175.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -52.65 -41.62 63.94 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.531 1.532 . . . . 0.0 113.15 172.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -56.83 -61.54 2.36 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.081 0.953 . . . . 0.0 110.588 172.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -56.5 -26.35 54.15 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 178.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.6 tmtt? -65.73 -48.42 71.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.284 1.434 . . . . 0.0 112.863 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -153.16 24.51 0.55 Allowed 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 115.277 1.584 . . . . 0.0 115.277 -176.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.3 mt -129.66 145.1 36.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 O-C-N 120.527 -1.358 . . . . 0.0 109.538 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.3 t -145.21 158.67 43.77 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 178.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.6 m-80 -90.72 3.44 54.28 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 126.487 1.915 . . . . 0.0 112.679 167.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.1 t -164.44 113.84 1.17 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.506 1.922 . . . . 0.0 111.3 174.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -66.57 104.25 1.24 Allowed 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.606 -1.309 . . . . 0.0 110.628 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -115.58 4.3 14.14 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.537 1.535 . . . . 0.0 113.374 178.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.0 p -72.68 145.21 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 C-N-CA 124.891 1.276 . . . . 0.0 112.721 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -132.47 5.66 4.06 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.17 1.788 . . . . 0.0 113.106 175.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 34.6 m 52.64 39.72 28.8 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.521 2.328 . . . . 0.0 114.378 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.409 ' O ' ' HA ' ' A' ' 1' ' ' ARG . 0.8 OUTLIER -153.87 -27.35 0.13 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 128.34 2.656 . . . . 0.0 112.213 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -109.1 2.36 21.08 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.709 1.603 . . . . 0.0 113.695 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 5.6 pt -61.58 -12.66 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.171 1.388 . . . . 0.0 113.6 177.061 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 1.4 tmt? -52.44 -34.15 47.46 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.641 1.176 . . . . 0.0 112.879 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.3 t -80.7 2.3 26.53 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.119 1.368 . . . . 0.0 114.218 177.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.1 p -121.19 -177.45 3.52 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 125.967 1.707 . . . . 0.0 111.845 -175.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -62.51 -19.66 63.83 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 172.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.73 7.31 24.11 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.315 1.846 . . . . 0.0 114.558 -171.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -64.07 -5.57 4.94 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.968 2.107 . . . . 0.0 114.904 -176.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.6 t-80 -61.92 -5.45 2.12 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.435 1.894 . . . . 0.0 114.681 -177.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.6 t 53.0 35.61 19.88 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.301 2.241 . . . . 0.0 114.847 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.84 160.57 17.16 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.868 1.667 . . . . 0.0 113.063 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -68.34 -27.32 66.16 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.059 1.744 . . . . 0.0 115.253 -171.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptmt -162.72 159.04 23.8 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.425 1.49 . . . . 0.0 112.404 166.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -134.19 141.78 47.18 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.3 1.04 . . . . 0.0 110.557 168.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.2 m -108.2 94.12 4.9 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.978 1.311 . . . . 0.0 109.532 178.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -78.98 136.09 37.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.973 0.416 . . . . 0.0 111.78 177.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 88.8 mt -113.26 115.65 50.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 126.077 1.751 . . . . 0.0 108.271 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -85.15 86.41 7.38 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 121.775 -0.578 . . . . 0.0 110.327 168.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 66.4 m -142.09 155.04 45.35 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.193 1.397 . . . . 0.0 112.748 176.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 61.1 mtp180 -70.36 161.78 74.16 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 124.239 1.016 . . . . 0.0 110.174 162.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -68.79 -22.33 37.02 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.764 1.643 . . . . 0.0 114.632 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -61.26 -58.19 20.6 Favored Pre-proline 0 N--CA 1.474 0.763 0 CA-C-N 119.691 1.132 . . . . 0.0 113.185 -177.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.21 0.5 5.14 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 123.339 2.692 . . . . 0.0 114.858 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.9 t -102.97 -55.07 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 C-N-CA 126.515 1.926 . . . . 0.0 109.712 176.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.0 -44.86 79.27 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.27 -0.894 . . . . 0.0 112.819 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.7 -3.08 32.73 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -173.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 60.9 mt -53.45 -35.81 25.98 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 C-N-CA 123.52 0.728 . . . . 0.0 110.473 169.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.2 p -109.29 158.94 17.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.461 1.104 . . . . 0.0 113.236 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -155.43 106.04 2.52 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.169 1.788 . . . . 0.0 109.961 178.44 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.79 4.09 87.57 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.483 1.04 . . . . 0.0 114.886 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 48.1 mt -75.73 115.15 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 118.5 1.15 . . . . 0.0 111.27 -177.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.0 mt -109.7 -11.89 11.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.628 1.971 . . . . 0.0 110.847 172.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 9.01 1.53 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 127.859 2.463 . . . . 0.0 116.1 -170.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 83.0 p 49.27 63.76 2.02 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.757 1.623 . . . . 0.0 113.455 -172.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -154.61 155.71 35.2 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 126.715 2.006 . . . . 0.0 111.116 -176.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.486 HD22 HG23 ' A' ' 16' ' ' VAL . 6.7 t-20 -141.9 -167.23 2.4 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.722 -1.236 . . . . 0.0 111.475 162.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 19.2 t -127.41 143.59 40.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.762 1.625 . . . . 0.0 108.711 170.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 44.0 tp -50.05 141.25 11.2 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.567 1.147 . . . . 0.0 111.968 168.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.46 173.2 1.28 Allowed 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 172.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.6 t -119.88 -32.74 4.16 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.75 1.22 . . . . 0.0 113.406 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.8 m -74.84 172.11 12.79 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 125.506 1.522 . . . . 0.0 112.168 175.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -121.21 116.63 25.27 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.583 1.153 . . . . 0.0 110.923 -176.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -113.54 157.25 22.28 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.913 1.685 . . . . 0.0 109.805 -171.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.63 112.45 4.17 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 118.398 0.545 . . . . 0.0 110.106 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -113.96 123.07 48.83 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.372 1.469 . . . . 0.0 110.843 -170.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 28.3 t -129.46 97.42 4.55 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.63 1.172 . . . . 0.0 109.924 -167.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -87.73 159.75 18.36 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.742 0.817 . . . . 0.0 110.779 171.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -145.08 128.09 16.52 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.963 0.905 . . . . 0.0 108.769 158.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -116.39 127.66 54.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.014 1.326 . . . . 0.0 109.849 -175.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 36.7 t -59.14 145.22 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-O 121.263 0.554 . . . . 0.0 112.111 -176.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 6.7 t -132.93 103.15 5.92 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.225 1.81 . . . . 0.0 110.955 175.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 99.2 p . . . . . 0 C--O 1.253 1.266 0 C-N-CA 125.601 1.56 . . . . 0.0 114.702 -179.481 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 12.2 ptp85 . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 118.407 -0.806 . . . . 0.0 111.824 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -67.87 -54.65 0.32 Allowed 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 121.994 1.796 . . . . 0.0 112.039 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.5 m -140.08 171.27 14.41 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.959 1.703 . . . . 0.0 110.477 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.1 mmmt -92.35 130.65 37.98 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.114 1.366 . . . . 0.0 110.252 -178.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.0 m-85 -137.54 161.04 37.46 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.412 1.085 . . . . 0.0 112.85 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -95.41 160.01 14.73 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 127.491 2.317 . . . . 0.0 111.665 178.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.47 106.16 18.43 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 125.957 1.703 . . . . 0.0 110.933 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -134.48 118.42 17.32 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.994 1.718 . . . . 0.0 111.377 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -125.64 152.92 44.55 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 125.117 1.367 . . . . 0.0 111.464 174.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 19.6 t -154.51 175.49 13.54 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.367 1.467 . . . . 0.0 111.42 177.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.9 m -144.88 101.65 3.67 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.956 -1.09 . . . . 0.0 110.441 173.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -163.72 178.64 7.72 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.082 1.353 . . . . 0.0 113.442 -178.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 170.78 9.16 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 128.053 2.541 . . . . 0.0 113.661 174.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 18.4 p90 -141.69 141.13 33.33 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 126.067 1.747 . . . . 0.0 112.065 -176.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 22.6 t -101.21 140.54 35.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.817 0.847 . . . . 0.0 111.793 175.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.488 HG23 HD22 ' A' ' 104' ' ' ASN . 15.5 m -146.58 -179.41 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 126.452 1.901 . . . . 0.0 111.251 -176.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.2 m -125.96 116.27 21.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.815 1.246 . . . . 0.0 111.04 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 m -85.29 132.32 34.28 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.594 0.634 . . . . 0.0 111.289 173.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -136.72 116.28 12.88 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 125.188 1.395 . . . . 0.0 108.323 174.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 57.87 55.98 5.04 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 124.86 1.264 . . . . 0.0 112.38 -170.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 65.33 25.18 12.13 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 127.439 2.295 . . . . 0.0 115.072 169.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.09 132.71 5.33 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.844 1.257 . . . . 0.0 109.787 -174.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -76.99 106.71 2.3 Favored 'Trans proline' 0 CA--C 1.539 0.747 0 C-N-CA 124.008 3.139 . . . . 0.0 113.5 -179.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 51' ' ' TRP . 3.3 m -108.65 14.95 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 126.888 2.075 . . . . 0.0 112.619 -178.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -151.66 143.91 24.02 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 120.612 -1.305 . . . . 0.0 111.672 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -100.63 132.68 45.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 111.425 176.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.1 t -107.85 -53.52 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 123.908 0.883 . . . . 0.0 111.982 -178.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 179.64 -172.5 44.28 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-N 118.93 0.786 . . . . 0.0 114.504 -173.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 3.0 t -126.18 128.88 72.04 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.479 1.511 . . . . 0.0 109.722 -176.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 64.58 2.92 8.3 Favored Glycine 0 CA--C 1.539 1.555 0 N-CA-C 116.354 1.302 . . . . 0.0 116.354 -177.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -168.88 163.39 11.61 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 128.555 2.742 . . . . 0.0 110.232 -176.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.1 m -108.48 120.55 42.73 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.733 1.613 . . . . 0.0 109.848 170.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.88 148.91 51.61 Favored Glycine 0 CA--C 1.538 1.496 0 C-N-CA 123.621 0.629 . . . . 0.0 112.765 174.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.6 t -70.98 155.98 40.17 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.961 0.905 . . . . 0.0 112.467 178.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -80.84 -176.08 50.28 Favored Glycine 0 CA--C 1.538 1.518 0 C-N-CA 125.07 1.319 . . . . 0.0 113.217 170.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 83.51 32.17 25.61 Favored Glycine 0 CA--C 1.537 1.424 0 C-N-CA 123.94 0.781 . . . . 0.0 115.014 174.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.4 p -112.72 160.1 18.28 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.954 1.702 . . . . 0.0 113.086 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.67 3.48 61.03 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 125.42 1.486 . . . . 0.0 115.269 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 45.4 mt -63.63 136.72 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.728 1.611 . . . . 0.0 110.629 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -145.92 18.56 1.44 Allowed 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.37 1.468 . . . . 0.0 113.38 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -88.19 -11.72 45.94 Favored 'General case' 0 N--CA 1.474 0.775 0 O-C-N 120.795 -1.191 . . . . 0.0 112.406 -173.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -72.44 168.71 17.91 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.276 1.831 . . . . 0.0 113.324 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.3 m -68.6 -33.26 73.74 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.67 0.788 . . . . 0.0 112.451 176.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 6.2 t 44.95 72.2 0.22 Allowed 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 127.075 2.15 . . . . 0.0 113.759 -176.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.8 mp -68.44 -0.29 4.79 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 125.236 1.414 . . . . 0.0 114.611 -178.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 73.0 m -60.99 -33.2 72.86 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.723 1.609 . . . . 0.0 115.013 177.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.4 113.22 10.98 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.84 1.256 . . . . 0.0 110.712 -176.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.83 0.13 62.41 Favored Glycine 0 CA--C 1.538 1.474 0 C-N-CA 124.99 1.281 . . . . 0.0 114.741 -175.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 9.0 m -136.41 -168.95 2.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.705 1.602 . . . . 0.0 110.95 173.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -152.94 171.64 18.02 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.146 1.378 . . . . 0.0 110.363 -176.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.442 ' N ' HG12 ' A' ' 24' ' ' VAL . 3.2 t-105 -55.37 -36.74 66.69 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.727 1.611 . . . . 0.0 111.406 167.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.81 -32.34 70.55 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.907 1.283 . . . . 0.0 112.465 -179.204 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 23.1 p -97.94 -24.72 15.26 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.763 1.225 . . . . 0.0 113.737 175.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -52.85 -40.21 63.2 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.768 1.627 . . . . 0.0 112.992 170.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -58.08 -61.59 2.44 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.779 0.832 . . . . 0.0 111.196 172.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.93 -28.73 38.79 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 9.8 tmtm? -66.42 -44.84 81.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.676 1.59 . . . . 0.0 114.042 -178.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -155.72 21.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -177.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.8 mt -127.59 146.52 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 O-C-N 120.145 -1.597 . . . . 0.0 109.412 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.45 154.64 43.15 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 177.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -88.89 2.1 54.3 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 125.949 1.7 . . . . 0.0 112.343 168.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.5 t -162.83 106.64 1.08 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.387 1.875 . . . . 0.0 111.409 174.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 28.6 ttp-105 -67.23 114.73 6.2 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 120.494 -1.379 . . . . 0.0 110.178 171.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -126.98 5.26 6.52 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.255 1.422 . . . . 0.0 113.293 176.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.52 HG22 ' H ' ' A' ' 67' ' ' CYS . 14.9 p -71.37 150.3 9.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 125.24 1.416 . . . . 0.0 113.125 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -132.62 3.3 3.84 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.012 1.725 . . . . 0.0 112.877 173.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.52 ' H ' HG22 ' A' ' 65' ' ' VAL 0.251 90.2 m 45.65 57.66 4.84 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.743 2.417 . . . . 0.0 112.083 -171.606 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -156.34 -43.69 0.07 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.585 2.354 . . . . 0.0 111.736 -163.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -113.47 0.02 14.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.714 2.005 . . . . 0.0 113.573 -176.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 7.2 pt -60.65 -11.03 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 125.21 1.404 . . . . 0.0 113.966 -178.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -25.76 29.21 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 167.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.5 t -89.4 -2.54 58.44 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.557 1.543 . . . . 0.0 113.794 176.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 p -108.82 -179.52 3.89 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.904 1.682 . . . . 0.0 111.51 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -69.45 -14.58 62.96 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 172.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -81.63 6.43 15.14 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.348 1.859 . . . . 0.0 114.743 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -65.23 -5.03 5.98 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 128.413 2.685 . . . . 0.0 115.237 -174.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -62.56 -2.32 1.06 Allowed 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.676 1.99 . . . . 0.0 115.25 -173.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 8.5 t 56.14 31.9 19.13 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.169 1.788 . . . . 0.0 113.263 -173.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.36 154.46 20.25 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.482 1.113 . . . . 0.0 112.03 176.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -63.64 -33.61 76.0 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.007 1.323 . . . . 0.0 113.692 -170.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -164.43 160.21 20.36 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 126.097 1.759 . . . . 0.0 112.123 175.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.7 t30 -138.26 123.62 19.42 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.227 1.011 . . . . 0.0 110.422 172.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 42.0 m -87.37 94.74 9.77 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.842 0.857 . . . . 0.0 109.428 173.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -78.75 132.85 37.09 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 122.002 -0.436 . . . . 0.0 111.1 172.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 86.1 mt -111.8 113.44 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.537 0 C-N-CA 125.55 1.54 . . . . 0.0 107.966 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -85.82 84.39 7.57 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 121.89 -0.506 . . . . 0.0 110.522 171.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 65.0 m -141.2 159.03 43.07 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.998 1.319 . . . . 0.0 113.249 177.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 40.9 mtt85 -71.41 162.71 71.29 Favored Pre-proline 0 N--CA 1.474 0.749 0 C-N-CA 124.739 1.216 . . . . 0.0 111.363 162.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -70.22 -23.73 28.38 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 122.556 2.171 . . . . 0.0 114.355 176.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -60.86 -58.23 20.8 Favored Pre-proline 0 CA--C 1.544 0.742 0 CA-C-N 119.68 1.127 . . . . 0.0 112.884 -177.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -69.89 0.89 5.08 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.034 2.489 . . . . 0.0 114.93 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.54 -57.4 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 126.937 2.095 . . . . 0.0 110.156 177.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -68.83 -40.03 79.67 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 121.335 -0.853 . . . . 0.0 112.708 -177.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -78.81 -3.5 44.82 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.617 1.34 . . . . 0.0 114.617 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 62.2 mt -52.84 -36.36 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 CA-C-N 118.777 0.717 . . . . 0.0 110.529 169.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.63 159.58 16.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.3 1.04 . . . . 0.0 113.081 174.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -156.0 104.99 2.32 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.535 1.534 . . . . 0.0 110.646 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 84.63 5.1 87.03 Favored Glycine 0 CA--C 1.536 1.39 0 C-N-CA 124.299 0.952 . . . . 0.0 114.99 -178.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 45.7 mt -75.28 115.87 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 118.534 1.167 . . . . 0.0 111.155 -178.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.2 mt -111.54 -11.92 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 126.629 1.972 . . . . 0.0 110.946 173.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -73.55 4.3 5.09 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.438 2.295 . . . . 0.0 116.007 -171.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.0 t 51.81 68.28 0.83 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.805 1.642 . . . . 0.0 113.041 -170.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -156.48 163.57 39.25 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.133 1.773 . . . . 0.0 111.018 176.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.488 HD22 HG23 ' A' ' 16' ' ' VAL . 6.8 t-20 -143.52 -165.37 2.08 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 120.884 -1.135 . . . . 0.0 111.338 163.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.0 p -125.21 146.83 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 125.448 1.499 . . . . 0.0 109.285 165.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 43.0 tp -50.96 142.11 12.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.623 1.169 . . . . 0.0 111.409 167.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.19 174.32 0.94 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 171.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 14.8 t -117.19 -32.55 4.96 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.769 1.228 . . . . 0.0 113.529 179.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.3 m -78.76 176.01 9.93 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.519 1.927 . . . . 0.0 112.325 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -121.81 111.03 16.63 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.099 -1.001 . . . . 0.0 111.49 -177.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 8.1 m-85 -107.95 160.33 15.85 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.203 1.801 . . . . 0.0 109.935 -174.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -70.91 110.78 5.84 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.687 -0.633 . . . . 0.0 110.845 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.16 126.87 50.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.813 1.645 . . . . 0.0 110.981 -178.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 40.3 t -132.23 96.9 3.98 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.686 1.194 . . . . 0.0 109.961 -171.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -103.6 135.66 44.76 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.157 1.383 . . . . 0.0 110.16 -178.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 22.1 m -116.83 146.25 43.01 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 120.936 -1.102 . . . . 0.0 108.646 168.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -134.94 124.42 24.89 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 124.035 0.934 . . . . 0.0 109.344 -178.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 22.3 t -58.01 147.37 6.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 124.015 0.926 . . . . 0.0 111.834 -179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 8.7 t -136.45 86.11 2.2 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 122.782 1.277 . . . . 0.0 112.836 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 61.3 m . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.198 1.799 . . . . 0.0 112.784 173.739 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 22.0 mtm180 . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -74.94 -52.11 0.11 Allowed 'Trans proline' 0 C--N 1.357 0.989 0 C-N-CA 122.411 2.074 . . . . 0.0 112.784 -169.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 85.9 m -140.4 168.27 20.2 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.575 2.35 . . . . 0.0 109.599 176.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -93.45 140.44 29.58 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.324 1.05 . . . . 0.0 110.22 175.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -137.64 160.86 38.02 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.699 1.2 . . . . 0.0 112.46 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.3 mtpt -94.46 153.74 17.78 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 126.741 2.016 . . . . 0.0 112.01 -178.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.18 103.59 16.25 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 125.381 1.473 . . . . 0.0 111.22 -174.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 20.5 tptm -133.64 118.83 18.64 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.143 1.377 . . . . 0.0 111.456 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -129.51 152.22 49.29 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 126.04 1.736 . . . . 0.0 110.942 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.8 m -155.23 175.11 14.28 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.92 1.688 . . . . 0.0 111.43 179.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.5 m -144.71 104.77 4.06 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 120.936 -1.103 . . . . 0.0 110.838 175.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -169.77 172.17 6.91 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.916 1.286 . . . . 0.0 113.405 -171.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 172.86 1.09 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 128.329 2.652 . . . . 0.0 114.224 168.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -141.17 143.01 33.98 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 126.639 1.975 . . . . 0.0 111.7 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 32.4 t -103.49 138.85 39.63 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.069 0.947 . . . . 0.0 111.097 176.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 15.5 m -145.45 -179.49 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.975 0 C-N-CA 125.905 1.682 . . . . 0.0 111.435 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.6 m -126.22 117.44 23.08 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.608 1.163 . . . . 0.0 111.527 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.4 t -83.87 130.08 34.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.832 0.853 . . . . 0.0 111.201 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -138.95 112.6 8.34 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 125.064 1.346 . . . . 0.0 108.925 176.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 58.82 58.51 3.21 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.154 1.382 . . . . 0.0 112.331 -172.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 62.84 27.64 16.1 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 127.27 2.228 . . . . 0.0 114.841 171.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.75 133.51 5.49 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.983 1.313 . . . . 0.0 109.767 -176.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.8 101.04 1.44 Allowed 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 124.149 3.232 . . . . 0.0 112.308 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.0 m -96.21 1.26 10.38 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.644 0 C-N-CA 125.11 1.364 . . . . 0.0 112.447 -178.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -143.82 139.83 29.53 Favored 'General case' 0 N--CA 1.483 1.201 0 CA-C-N 121.357 1.89 . . . . 0.0 110.997 -171.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -88.38 145.38 25.83 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.155 0.582 . . . . 0.0 110.294 172.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 73.6 t -114.43 -57.37 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.735 0.814 . . . . 0.0 111.426 173.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -177.09 -174.79 43.83 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 123.981 0.8 . . . . 0.0 112.509 -172.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 p -131.73 132.61 61.93 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 C-N-CA 123.588 0.755 . . . . 0.0 112.118 -173.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 68.08 0.19 14.04 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 115.287 0.875 . . . . 0.0 115.287 -173.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 96.2 p -173.81 167.83 4.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 128.684 2.794 . . . . 0.0 110.321 -172.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.1 m -104.78 113.84 27.68 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.122 1.369 . . . . 0.0 110.707 172.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -82.74 74.93 2.44 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 125.228 1.394 . . . . 0.0 112.879 -177.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.5 t -65.34 163.82 14.81 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.327 1.051 . . . . 0.0 112.847 176.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.16 169.45 15.93 Favored Glycine 0 CA--C 1.537 1.437 0 C-N-CA 126.528 2.013 . . . . 0.0 113.823 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -90.45 73.54 1.86 Allowed Glycine 0 CA--C 1.531 1.066 0 C-N-CA 125.241 1.4 . . . . 0.0 112.933 -176.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 81.6 p -63.45 158.34 21.01 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 176.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -116.6 22.12 11.09 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 125.886 1.708 . . . . 0.0 114.328 -175.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 60.9 mt -64.37 135.07 28.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 125.48 1.512 . . . . 0.0 110.264 -174.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -131.56 -1.26 3.89 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.136 1.774 . . . . 0.0 113.221 -178.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.31 -31.48 72.71 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.234 1.814 . . . . 0.0 112.326 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -144.68 161.93 37.95 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.998 2.119 . . . . 0.0 112.032 178.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 27.0 m -70.78 -24.07 62.52 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.827 1.651 . . . . 0.0 112.08 167.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.0 t 52.34 29.48 6.87 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.612 1.965 . . . . 0.0 113.519 -172.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 5.6 mp 53.13 85.98 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.876 2.471 . . . . 0.0 112.616 -176.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 24.6 t -121.79 -55.05 1.92 Allowed 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.498 1.519 . . . . 0.0 113.183 -176.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -118.33 119.3 34.23 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.291 1.436 . . . . 0.0 111.579 -176.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.38 6.63 70.62 Favored Glycine 0 CA--C 1.538 1.494 0 C-N-CA 124.742 1.163 . . . . 0.0 115.253 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 14.7 p -88.44 175.94 7.39 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.226 2.21 . . . . 0.0 112.165 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -153.26 158.2 41.31 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 123.259 1.504 . . . . 0.0 113.429 176.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 2.2 t-105 -55.97 -33.61 64.95 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.066 1.746 . . . . 0.0 112.863 171.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -44.52 92.71 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.09 -1.006 . . . . 0.0 111.039 -178.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.8 p -81.49 -24.7 36.55 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.503 1.521 . . . . 0.0 114.563 173.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -51.3 -43.59 61.71 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.211 1.404 . . . . 0.0 112.126 174.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 29.7 mt-30 -57.89 -63.08 1.37 Allowed 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 124.596 1.158 . . . . 0.0 110.922 175.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.58 -21.52 53.29 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -178.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -65.98 -48.74 70.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.354 1.461 . . . . 0.0 114.431 174.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -152.36 19.96 0.64 Allowed 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.1 mt -125.63 149.98 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.768 1.627 . . . . 0.0 108.527 177.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -144.51 156.86 44.37 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.453 0.644 . . . . 0.0 112.532 175.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -93.0 4.35 54.16 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 125.716 1.606 . . . . 0.0 112.16 169.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 t -160.73 111.76 1.83 Allowed 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 126.647 1.979 . . . . 0.0 111.015 173.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 71.0 ttp85 -67.08 101.72 0.91 Allowed 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.564 -1.335 . . . . 0.0 110.557 172.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -113.85 4.42 15.87 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.654 1.582 . . . . 0.0 113.2 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.5 p -72.43 141.67 16.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 124.682 1.193 . . . . 0.0 112.427 178.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -128.7 7.94 5.75 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.476 1.91 . . . . 0.0 112.698 172.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.5 m 49.87 47.12 23.55 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 128.054 2.542 . . . . 0.0 113.685 -178.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -163.0 -28.46 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.029 2.531 . . . . 0.0 111.86 179.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -105.93 0.7 26.04 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.465 1.506 . . . . 0.0 113.853 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 4.4 pt -60.94 -11.69 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 125.035 1.334 . . . . 0.0 113.686 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -23.69 28.85 Favored 'General case' 0 CA--C 1.544 0.75 0 N-CA-C 114.787 1.403 . . . . 0.0 114.787 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 95.3 p -96.11 -4.9 41.99 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 176.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.5 p -97.04 -176.01 3.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.824 1.65 . . . . 0.0 111.476 177.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 55.7 m-80 -64.75 -18.02 64.67 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 170.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -92.7 11.79 25.59 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.99 1.716 . . . . 0.0 114.145 -169.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -63.57 -8.46 9.78 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 127.823 2.449 . . . . 0.0 115.229 -175.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -62.75 -7.44 4.96 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 126.504 1.921 . . . . 0.0 114.71 -173.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 53.2 t 38.38 61.24 1.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.947 2.099 . . . . 0.0 113.653 -166.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.95 161.23 26.98 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.881 1.273 . . . . 0.0 112.11 160.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.25 -32.25 73.55 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.512 1.525 . . . . 0.0 114.525 -172.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 12.6 ptmt -161.84 160.2 27.83 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 169.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -135.03 118.69 17.06 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.836 0.854 . . . . 0.0 110.888 171.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 25.8 m -81.84 95.55 7.35 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.036 0.534 . . . . 0.0 109.708 172.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 72.5 m-85 -80.94 131.05 35.31 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 121.811 -0.556 . . . . 0.0 111.892 175.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 71.2 mt -106.76 115.24 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 125.38 1.472 . . . . 0.0 107.779 173.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -88.21 92.53 9.19 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 121.044 0.449 . . . . 0.0 109.89 167.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.2 t -147.44 -173.7 4.33 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.635 1.174 . . . . 0.0 112.999 176.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.1 mmt85 -99.91 162.53 20.75 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 128.368 2.667 . . . . 0.0 110.995 172.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.0 -25.23 23.11 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 122.431 2.087 . . . . 0.0 114.244 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -61.74 -58.41 18.36 Favored Pre-proline 0 CA--C 1.545 0.75 0 CA-C-O 118.044 -0.979 . . . . 0.0 113.036 -177.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -69.3 0.35 5.42 Favored 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 123.336 2.69 . . . . 0.0 114.831 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 23.5 t -102.33 -58.66 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 126.85 2.06 . . . . 0.0 110.001 176.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.27 -38.86 82.17 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.319 -0.863 . . . . 0.0 112.777 -177.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -77.99 -4.49 47.29 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -176.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 66.5 mt -53.23 -35.02 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 CA-C-N 118.858 0.754 . . . . 0.0 110.798 170.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 19.7 p -113.24 158.08 20.94 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.005 1.322 . . . . 0.0 113.077 174.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -153.93 104.73 2.69 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.942 1.697 . . . . 0.0 110.373 -179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 83.84 4.97 88.41 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 124.206 0.908 . . . . 0.0 114.986 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 47.4 mt -76.35 118.82 23.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 118.607 1.203 . . . . 0.0 111.131 -177.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 3.3 mt -115.69 -6.36 11.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 126.943 2.097 . . . . 0.0 110.829 173.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -77.04 7.93 4.41 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 127.383 2.273 . . . . 0.0 115.682 -172.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 85.2 p 50.43 61.48 3.18 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.867 1.667 . . . . 0.0 113.912 -174.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -157.58 154.17 28.07 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 126.284 1.833 . . . . 0.0 110.54 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -137.99 -169.81 2.64 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.095 -1.003 . . . . 0.0 111.63 166.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.4 p -122.63 144.38 32.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.671 1.588 . . . . 0.0 109.354 169.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 37.6 tp -52.51 141.79 19.35 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.526 1.131 . . . . 0.0 111.49 169.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.31 172.25 1.57 Allowed 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 121.923 0.868 . . . . 0.0 113.265 172.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 15.3 t -117.67 -30.69 5.39 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.817 1.247 . . . . 0.0 113.263 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 50.6 m -78.85 170.72 16.24 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.464 1.506 . . . . 0.0 112.15 177.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -118.51 108.12 14.61 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.577 1.151 . . . . 0.0 111.063 -176.401 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -100.8 161.55 13.52 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.61 1.564 . . . . 0.0 110.324 -173.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -70.38 108.34 4.2 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.735 -0.603 . . . . 0.0 110.125 179.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.35 130.4 47.52 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 124.695 1.198 . . . . 0.0 111.888 -175.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 43.9 t -135.93 95.36 3.2 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.096 0.959 . . . . 0.0 110.85 -172.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -86.54 162.56 17.97 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.723 0.773 . . . . 0.0 111.162 170.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -151.72 135.15 16.08 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.482 1.113 . . . . 0.0 108.975 157.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 -120.46 130.43 54.3 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.063 1.345 . . . . 0.0 110.442 -176.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 25.5 t -57.5 145.54 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 124.006 0.922 . . . . 0.0 111.925 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.8 t -135.41 78.21 1.71 Allowed 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.681 1.192 . . . . 0.0 112.354 176.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.253 1.254 0 C-N-CA 126.185 1.794 . . . . 0.0 112.924 172.853 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -75.24 -40.37 0.86 Allowed 'Trans proline' 0 C--N 1.355 0.92 0 C-N-CA 122.068 1.846 . . . . 0.0 113.329 -176.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -141.38 179.67 6.65 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.224 2.209 . . . . 0.0 110.275 -176.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -109.87 127.52 54.76 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.237 1.415 . . . . 0.0 110.373 175.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -137.91 163.62 31.02 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.531 1.132 . . . . 0.0 113.36 -177.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 36.1 mtpt -104.24 157.63 17.0 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 127.59 2.356 . . . . 0.0 111.626 175.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -90.58 113.7 25.77 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.385 1.874 . . . . 0.0 110.84 -177.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -136.13 102.63 5.07 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.842 1.257 . . . . 0.0 113.092 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -102.61 146.07 28.72 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.285 1.434 . . . . 0.0 111.368 173.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 71.1 m -145.69 169.69 17.97 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.227 1.811 . . . . 0.0 111.183 174.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.5 m -144.44 104.32 4.06 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 120.87 -1.144 . . . . 0.0 111.039 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -170.34 173.12 5.83 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.02 1.328 . . . . 0.0 113.163 -170.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.61 175.63 1.04 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 127.359 2.264 . . . . 0.0 114.315 169.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 p90 -143.66 144.76 32.02 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.221 1.809 . . . . 0.0 111.755 177.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 24.5 t -104.6 141.32 36.62 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.446 1.098 . . . . 0.0 110.847 177.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.474 HG23 HD22 ' A' ' 104' ' ' ASN . 16.6 m -148.24 -178.31 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 126.024 1.73 . . . . 0.0 111.738 -173.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.0 m -127.98 115.82 19.11 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 125.129 1.372 . . . . 0.0 111.541 177.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.4 m -85.67 132.62 34.12 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.545 0.738 . . . . 0.0 111.857 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -135.85 117.2 14.64 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.441 1.496 . . . . 0.0 108.453 173.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 56.45 56.29 5.8 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.744 1.218 . . . . 0.0 112.357 -171.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 mp0 65.21 25.21 12.32 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 127.496 2.318 . . . . 0.0 115.038 169.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -157.93 132.34 5.21 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.784 1.234 . . . . 0.0 109.723 -174.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -75.71 109.81 2.97 Favored 'Trans proline' 0 CA--C 1.537 0.656 0 C-N-CA 123.595 2.863 . . . . 0.0 113.468 -178.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.2 m -108.84 17.19 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.606 1.963 . . . . 0.0 112.686 179.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -153.8 144.67 22.67 Favored 'General case' 0 N--CA 1.477 0.911 0 O-C-N 120.635 -1.29 . . . . 0.0 111.871 174.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -88.25 149.23 23.94 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.574 0.749 . . . . 0.0 110.056 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 81.9 t -124.5 -45.86 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.657 0.783 . . . . 0.0 112.515 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.29 -179.39 48.23 Favored Glycine 0 CA--C 1.527 0.803 0 CA-C-N 118.98 0.809 . . . . 0.0 114.12 -175.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.8 p -132.36 118.66 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.54 1.536 . . . . 0.0 110.704 -172.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.21 2.28 58.59 Favored Glycine 0 CA--C 1.541 1.694 0 C-N-CA 124.139 0.876 . . . . 0.0 114.909 -172.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 94.0 p -173.77 169.19 4.23 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.466 2.706 . . . . 0.0 110.097 -173.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 80.7 m -104.23 143.6 32.73 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.888 1.275 . . . . 0.0 109.085 165.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.88 156.71 53.48 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 123.518 0.58 . . . . 0.0 112.287 171.388 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 7.2 t -70.18 156.38 39.31 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 122.042 -0.681 . . . . 0.0 112.061 177.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -89.81 174.37 40.91 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 124.83 1.205 . . . . 0.0 114.165 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 82.19 -0.91 88.3 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.148 1.356 . . . . 0.0 116.076 174.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 53.5 m -79.32 162.42 25.61 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.447 1.499 . . . . 0.0 113.099 179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -109.16 15.9 32.91 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 125.881 1.705 . . . . 0.0 115.403 -176.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 56.8 mt -61.72 137.42 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.656 1.583 . . . . 0.0 111.264 -174.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -143.32 19.1 1.9 Allowed 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 125.824 1.649 . . . . 0.0 113.136 -179.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 82.0 mt -80.97 -14.9 57.54 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.685 -1.259 . . . . 0.0 112.748 -175.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -85.99 173.35 9.98 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 126.214 1.806 . . . . 0.0 112.821 -178.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.1 m -59.81 -34.89 73.64 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.602 1.161 . . . . 0.0 112.492 173.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 4.1 t 44.39 73.15 0.16 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 127.751 2.42 . . . . 0.0 114.379 -177.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 4.9 mp -67.03 1.67 1.86 Allowed 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 126.457 1.903 . . . . 0.0 115.834 -174.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.8 m -61.6 -32.52 72.64 Favored 'General case' 0 N--CA 1.481 1.097 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -135.85 115.46 12.84 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.326 1.45 . . . . 0.0 110.342 -175.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.43 0.1 67.69 Favored Glycine 0 CA--C 1.538 1.51 0 C-N-CA 124.733 1.158 . . . . 0.0 114.739 -175.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.9 m -138.4 -174.5 3.83 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.227 1.411 . . . . 0.0 110.804 173.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -158.32 175.78 13.3 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.995 1.718 . . . . 0.0 110.855 -175.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -60.05 -34.81 73.93 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.732 1.613 . . . . 0.0 113.075 177.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.35 -44.38 96.62 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.316 -0.865 . . . . 0.0 110.578 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 68.0 p -79.54 -26.76 41.36 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 174.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -52.38 -43.23 64.61 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.858 1.663 . . . . 0.0 112.889 175.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -57.46 -61.45 2.48 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.409 1.084 . . . . 0.0 110.813 174.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.52 -26.95 56.22 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -49.75 68.74 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.313 1.445 . . . . 0.0 114.441 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.1 p80 -149.57 20.57 0.92 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 114.884 1.439 . . . . 0.0 114.884 -174.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 4.4 mt -127.85 147.48 32.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.323 . . . . 0.0 109.566 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.7 t -144.12 154.58 43.33 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.5 0.926 . . . . 0.0 113.5 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 67.9 m-80 -87.63 0.68 55.32 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 126.05 1.74 . . . . 0.0 112.54 167.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.5 t -164.02 105.02 0.9 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.364 1.866 . . . . 0.0 111.202 176.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 47.2 ttp85 -67.41 105.81 1.91 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 120.558 -1.339 . . . . 0.0 110.934 173.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -117.75 3.75 12.28 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.527 1.531 . . . . 0.0 113.116 173.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 48.9 t -79.01 143.27 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.799 1.24 . . . . 0.0 111.66 -175.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -131.96 6.42 4.28 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.746 1.619 . . . . 0.0 113.313 -177.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 76.2 m 50.43 46.72 24.98 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 126.838 2.055 . . . . 0.0 113.751 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -152.34 -29.14 0.16 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 127.118 2.167 . . . . 0.0 113.049 177.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -105.05 -2.72 24.05 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.307 1.443 . . . . 0.0 113.733 179.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 6.4 pt -60.26 -12.52 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 C-N-CA 125.656 1.582 . . . . 0.0 114.304 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -32.34 56.16 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.911 0.884 . . . . 0.0 112.018 167.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 3.8 t -88.7 -6.44 57.45 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.781 1.632 . . . . 0.0 114.461 178.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.4 p -109.73 -174.52 2.52 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.209 1.403 . . . . 0.0 112.191 -176.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 60.1 m-80 -62.04 -20.83 64.38 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 120.917 -1.115 . . . . 0.0 113.618 175.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -94.67 17.4 13.48 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.157 1.783 . . . . 0.0 113.509 -169.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -67.57 -8.44 34.23 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 127.479 2.312 . . . . 0.0 114.72 -172.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -62.15 -3.62 1.36 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.973 2.509 . . . . 0.0 115.312 -174.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.5 t 52.33 34.23 14.48 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 127.254 2.222 . . . . 0.0 115.054 176.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.26 164.31 5.53 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 126.503 1.921 . . . . 0.0 113.453 171.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -62.99 -39.59 95.19 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 124.948 1.299 . . . . 0.0 113.979 -173.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -161.02 164.79 30.69 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.487 1.515 . . . . 0.0 112.631 171.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -131.4 147.19 52.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.276 1.03 . . . . 0.0 109.952 164.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 47.3 m -107.3 92.55 4.12 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.183 1.393 . . . . 0.0 109.436 176.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -80.16 124.83 29.13 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.695 0.798 . . . . 0.0 111.708 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 89.0 mt -99.68 117.55 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 125.769 1.628 . . . . 0.0 108.432 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -87.56 86.35 7.2 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.573 -0.704 . . . . 0.0 110.53 169.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.0 m -142.9 156.96 45.0 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.381 1.473 . . . . 0.0 112.965 178.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 67.0 mtp180 -71.47 162.94 70.09 Favored Pre-proline 0 N--CA 1.476 0.826 0 C-N-CA 124.699 1.199 . . . . 0.0 110.585 163.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -70.02 -23.39 29.65 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.076 1.851 . . . . 0.0 114.52 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -61.25 -57.64 24.34 Favored Pre-proline 0 N--CA 1.475 0.783 0 CA-C-O 118.059 -0.972 . . . . 0.0 113.036 -177.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.68 0.32 5.75 Favored 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.035 2.49 . . . . 0.0 114.949 179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 19.8 t -102.78 -54.45 6.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 126.527 1.931 . . . . 0.0 109.813 176.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.07 -45.6 76.86 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 121.214 -0.929 . . . . 0.0 112.712 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -75.96 -2.93 32.8 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 -172.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 57.0 mt -53.34 -36.23 26.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 123.501 0.72 . . . . 0.0 110.376 169.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 31.1 p -108.09 158.24 17.58 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.218 1.007 . . . . 0.0 113.172 172.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -155.97 101.51 2.11 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.129 1.771 . . . . 0.0 109.992 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.12 2.98 79.86 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.58 1.086 . . . . 0.0 114.88 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 46.2 mt -73.52 116.07 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 118.615 1.207 . . . . 0.0 111.249 -178.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.4 mt -108.8 -13.11 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 110.874 171.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.67 5.64 2.99 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 127.623 2.369 . . . . 0.0 116.298 -169.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.9 t 52.08 64.34 1.89 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.446 1.499 . . . . 0.0 112.661 -172.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -155.02 160.43 41.05 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.992 1.717 . . . . 0.0 111.262 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.474 HD22 HG23 ' A' ' 16' ' ' VAL . 6.5 t-20 -144.67 -166.73 2.47 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 120.682 -1.262 . . . . 0.0 111.509 163.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 12.7 p -125.62 148.68 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 C-N-CA 125.654 1.582 . . . . 0.0 109.589 167.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 38.1 tp -54.01 142.16 25.87 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.641 1.177 . . . . 0.0 111.476 168.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.27 172.67 2.36 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 122.558 1.17 . . . . 0.0 113.46 171.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 18.1 p -115.89 -36.83 4.04 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.407 1.883 . . . . 0.0 112.93 -176.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.1 m -74.52 171.7 13.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 126.556 1.942 . . . . 0.0 112.708 177.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -119.54 105.01 10.81 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.588 1.155 . . . . 0.0 111.31 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -98.29 162.6 13.1 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.866 1.666 . . . . 0.0 110.309 -175.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -71.51 107.38 4.38 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.726 -0.609 . . . . 0.0 110.11 177.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -100.58 129.76 46.55 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.49 1.116 . . . . 0.0 111.53 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 29.5 t -130.28 94.11 3.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.436 1.494 . . . . 0.0 109.497 -172.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -87.95 164.23 15.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 122.398 1.094 . . . . 0.0 110.663 170.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . . . . . . . . . 11.5 m -129.57 168.29 16.63 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.958 1.303 . . . . 0.0 109.096 153.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 58.7 m-80 -144.43 124.21 13.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.168 -0.958 . . . . 0.0 109.632 172.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 10.6 p -55.07 146.15 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 C-N-CA 123.916 0.887 . . . . 0.0 112.473 177.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.6 t -131.85 80.65 1.93 Allowed 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 125.283 1.433 . . . . 0.0 111.003 174.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.2 m . . . . . 0 C--O 1.253 1.276 0 C-N-CA 127.266 2.226 . . . . 0.0 113.567 178.655 . . . . . . . . 0 0 . 1 stop_ save_